SCHEMBL820658

SCHEMBL820658

CCCC(O)C(=O)OCC

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.43
LMNA P02545 1/20 0.42
HSD17B10 Q99714 1/20 0.42
POLB P06746 1/20 0.41
ALOX15 P16050 1/20 0.40
MGAM O43451 1/20 0.40
GAA P10253 1/20 0.40
SI P14410 1/20 0.40
MGAM2 Q2M2H8 1/20 0.40
SOAT1 P35610 1/20 0.40
CHRM1 P11229 1/20 0.39
AKR1A1 P14550 1/20 0.39
CHRM3 P20309 1/20 0.39
HTR2A P28223 1/20 0.39
HTR2C P28335 1/20 0.39
ADRA1A P35348 1/20 0.39
HRH1 P35367 1/20 0.39
DRD3 P35462 1/20 0.39
SLC6A3 Q01959 1/20 0.39
HDAC1 Q13547 1/20 0.39

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL6515451 1.00 ALDH1A1 (0.43) ALDH1A1LMNAHSD17B10POLBALOX15
Alcohol SCHEMBL29062661 0.95 ALDH1A1 (0.40) ALDH1A1LMNAHSD17B10POLBALOX15
SCHEMBL27724226 0.86 GPR84 (0.48) ALDH1A1LMNAHSD17B10TDP1CYP3A4
SCHEMBL309000 0.86 GPR84 (0.48) ALDH1A1LMNAHSD17B10TDP1CYP3A4
SCHEMBL3019408 0.85 MGAM (0.43) ALDH1A1LMNAHSD17B10POLBMGAM
SCHEMBL3019389 0.84 GPR84 (0.57) NFKB1GPR84FFAR1
SCHEMBL4644432 0.83
SCHEMBL4714979 0.83 HDAC1 (0.39) ALDH1A1LMNACHRM1AKR1A1CHRM3
SCHEMBL17080322 0.83 ALDH1A1 (0.42) ALDH1A1LMNAHSD17B10POLBALOX15
SCHEMBL27896646 0.83 ALDH1A1 (0.42) ALDH1A1LMNAHSD17B10POLBALOX15

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 224 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117903582-A Full-biodegradation polylactic acid composite material and application thereof 上海汉禾生物新材料科技有限公司 2024-04-19 CN claimed
CN-112543676-B Catalyst with addition of alkyl lactate, preparation thereof and use thereof in hydrotreating and/or hydrocracking process IFP 新能源公司 2024-03-01 CN claimed
CN-116693824-A Beta-hydroxy fatty acid ester polymer and method for preparing beta-hydroxy fatty acid ester polymer by transesterification polycondensation method 中国科学院成都有机化学有限公司 2023-09-05 CN claimed
US-11534742-B2 Catalyst additivated with alkyl lactate, preparation thereof and use thereof in a hydrotreating and/or hydrocracking process IFP Energies Nouvelles (FR) 2022-12-27 US claimed
CN-115304516-A Compounds with unconventional chromophores, their preparation and use 四川大学 2022-11-08 CN claimed
US-20210229082-A1 CATALYST ADDITIVATED WITH ALKYL LACTATE, PREPARATION THEREOF AND USE THEREOF IN A HYDROTREATING AND/OR HYDROCRACKING PROCESS IFP Energies Nouvelles (FR) 2021-07-29 US claimed
EP-3814006-A1 CATALYST ADDITIVATED WITH ALKYL LACTATE, PREPARATION THEREOF AND USE THEREOF IN A HYDROTREATING AND/OR HYDROCRACKING PROCESS IFP Energies nouvelles (FR) 2021-05-05 EP claimed
CN-112543676-A Catalyst with addition of alkyl lactate, its preparation and its use in hydrotreating and/or hydrocracking processes IFP 新能源公司 2021-03-23 CN claimed
WO-2020002139-A1 CATALYST ADDITIVATED WITH ALKYL LACTATE, PREPARATION THEREOF AND USE THEREOF IN A HYDROTREATING AND/OR HYDROCRACKING PROCESS IFP Energies Nouvelles (FR) 2020-01-02 WO claimed
US-8874019-B2 Image forming method KONICA MINOLTA BUSINESS TECHNOLOGIES, INC. (JP) 2014-10-28 US claimed
US-20030105100-A1 Substituted polycyclic aryl and heteroaryl tertiary-heteroalkylamines useful for inhibiting cholesteryl ester transfer protein activity G.D. SEARLE & CO. 2003-06-05 US claimed
US-20030100559-A1 Substituted polycyclic aryl and heteroaryl tertiary-heteroalkylamines useful for inhibiting cholesteryl ester transfer protein activity G.D. SEARLE & CO. 2003-05-29 US claimed
US-20030096818-A1 Substituted polycyclic aryl and heteroaryl tertiary-heteroalkylamines useful for inhibiting cholesteryl ester transfer protein activity G.D. SEARLE & CO. (US) 2003-05-22 US claimed
US-20030087905-A1 Substituted polycyclic aryl and heteroaryl tertiary-heteroalkylamines useful for inhibiting cholesteryl ester transfer protein activity G.D. SEARLE & CO. 2003-05-08 US claimed
US-20030083331-A1 Substituted polycyclic aryl and heteroaryl tertiary-heteroalkylamines useful for inhibiting cholesteryl ester transfer protein activity G.D. SEARLE & CO. (US) 2003-05-01 US claimed
US-20030032644-A1 Substituted polycyclic aryl and heteroaryl tertiary-heteroalkylamines useful for inhibiting cholesteryl ester transfer protein activity G.D. SEARLE & CO. 2003-02-13 US claimed
US-20020165232-A1 Substituted N, N-disubstituted cycloalkyl aminoalcohol compounds useful for inhibiting cholesteryl ester transfer protein activity SIKORSKI JAMES A (US) 2002-11-07 US claimed
US-20020165231-A1 Substituted N-heteroaryl-N-phenyl aminoalcohol compounds useful for inhibiting cholesteryl ester transfer protein activity SIKORSKI JAMES A (US) 2002-11-07 US claimed
EP-1115693-A1 SUBSTITUTED POLYCYCLIC ARYL AND HETEROARYL $i(TERTIARY)-HETEROALKYLAMINES USEFUL FOR INHIBITING CHOLESTERYL ESTER TRANSFER PROTEIN ACTIVITY Monsanto Company (US) 2001-07-18 EP claimed
WO-2000018721-A1 SUBSTITUTED POLYCYCLIC ARYL AND HETEROARYL TERTIARY-HETEROALKYLAMINES USEFUL FOR INHIBITING CHOLESTERYL ESTER TRANSFER PROTEIN ACTIVITY MONSANTO COMPANY (US) 2000-04-06 WO claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (8 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20030105100-A1 Substituted polycyclic aryl and heteroaryl tertiary-heteroalkylamines useful for inhibiting cholesteryl ester transfer protein activity CETP, MTTP, LCAT ALDH1A1 2277/4885LMNA 1614/4885HSD17B10 374/4885
US-20030096818-A1 Substituted polycyclic aryl and heteroaryl tertiary-heteroalkylamines useful for inhibiting cholesteryl ester transfer protein activity CETP, MTTP, LCAT ALDH1A1 2277/4885LMNA 1614/4885HSD17B10 374/4885
US-20020165231-A1 Substituted N-heteroaryl-N-phenyl aminoalcohol compounds useful for inhibiting cholesteryl ester transfer protein activity CETP, LCAT, MTTP ALDH1A1 2079/4885LMNA 1157/4885HSD17B10 419/4885
US-20030087905-A1 Substituted polycyclic aryl and heteroaryl tertiary-heteroalkylamines useful for inhibiting cholesteryl ester transfer protein activity CETP, MTTP, LCAT ALDH1A1 2277/4885LMNA 1614/4885HSD17B10 374/4885
US-20030100559-A1 Substituted polycyclic aryl and heteroaryl tertiary-heteroalkylamines useful for inhibiting cholesteryl ester transfer protein activity CETP, MTTP, LCAT ALDH1A1 2277/4885LMNA 1614/4885HSD17B10 374/4885
US-20030083331-A1 Substituted polycyclic aryl and heteroaryl tertiary-heteroalkylamines useful for inhibiting cholesteryl ester transfer protein activity CETP, MTTP, LCAT ALDH1A1 2277/4885LMNA 1614/4885HSD17B10 374/4885
US-20030032644-A1 Substituted polycyclic aryl and heteroaryl tertiary-heteroalkylamines useful for inhibiting cholesteryl ester transfer protein activity CETP, MTTP, PCTP ALDH1A1 2611/4885LMNA 848/4885HSD17B10 257/4885
US-20020165232-A1 Substituted N, N-disubstituted cycloalkyl aminoalcohol compounds useful for inhibiting cholesteryl ester transfer protein activity CETP, DBI, PLTP ALDH1A1 2588/4885LMNA 1297/4885HSD17B10 553/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.