SCHEMBL146982

SCHEMBL146982

CCCCc1[c]c(CCCC)cc(CCCC)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.48
NPC1 O15118 1/20 0.48
MAPK1 P28482 1/20 0.48
HTT P42858 1/20 0.48
RAB9A P51151 1/20 0.48
NPSR1 Q6W5P4 1/20 0.48
PTGS2 P35354 4/20 0.45
CYP3A4 P08684 2/20 0.45
GPR84 Q9NQS5 2/20 0.39
SKP2 Q13309 1/20 0.39
CA2 P00918 3/20 0.38
CA1 P00915 2/20 0.38
ALDH1A1 P00352 2/20 0.36
HSD17B10 Q99714 2/20 0.36
SMN1; SMN2 Q16637 1/20 0.35
CA9 Q16790 1/20 0.35
KDM4E B2RXH2 1/20 0.34
LMNA P02545 1/20 0.34
ESR1 P03372 1/20 0.34
SHBG P04278 1/20 0.34

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
SCHEMBL5054846 0.94 PTGS2 (0.44) HPGDNPC1MAPK1HTTRAB9A
SCHEMBL8436317 0.93 PTGS2 (0.54) HPGDNPC1MAPK1HTTRAB9A
SCHEMBL19357908 0.91 PTGS2 (0.55) PTGS2CYP3A4GPR84ALDH1A1HSD17B10
SCHEMBL1777432 0.91 PTGS2 (0.55) PTGS2CYP3A4GPR84ALDH1A1HSD17B10
SCHEMBL19358002 0.91 PTGS2 (0.55) PTGS2CYP3A4GPR84ALDH1A1HSD17B10
SCHEMBL19358152 0.91 PTGS2 (0.55) PTGS2CYP3A4GPR84ALDH1A1HSD17B10
SCHEMBL19358155 0.91 PTGS2 (0.55) PTGS2CYP3A4GPR84ALDH1A1HSD17B10
SCHEMBL19358108 0.91 PTGS2 (0.55) PTGS2CYP3A4GPR84ALDH1A1HSD17B10
SCHEMBL19358148 0.91 PTGS2 (0.55) PTGS2CYP3A4GPR84ALDH1A1HSD17B10
SCHEMBL25423627 0.89 HPGD (0.48) HPGDNPC1MAPK1HTTRAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240216900-A1 SABRE CATALYSTS CONTAINING FLUORINATED CARBON CHAINS FOR DELIVERY OF METAL-FREE MRI CONTRAST AGENTS THE U.S.A., AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2024-07-04 US claimed
CN-113260603-B Preparation of 5-aryl pentanols 巴斯夫欧洲公司 2023-12-01 CN claimed
WO-2023196594-A2 SABRE CATALYSTS CONTAINING FLUORINATED CARBON CHAINS FOR DELIVERY OF METAL-FREE MRI CONTRAST AGENTS THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2023-10-12 WO claimed
EP-3908566-B1 PREPARATION OF 5-ARYL PENTANOLS BASF SE (DE) 2023-07-26 EP claimed
US-11365168-B2 Preparation of 5-aryl-pentanols BASF SE (DE) 2022-06-21 US claimed
EP-3908566-A1 PREPARATION OF 5-ARYL-PENTANOLS BASF SE (DE) 2021-11-17 EP claimed
CN-113260603-A Preparation of 5-arylpentanols 巴斯夫欧洲公司 2021-08-13 CN claimed
CN-111978953-A Long-afterglow luminescent composition based on BODIPY luminophor and application 复旦大学 2020-11-24 CN claimed
WO-2020144307-A1 PREPARATION OF 5-ARYL-PENTANOLS BASF SE (DE) 2020-07-16 WO claimed
US-10441946-B2 Linear alpha-olefin catalysts and preparation and use thereof APALENE TECHNOLOGY CO., LTD. (HANGZHOU) (CN) 2019-10-15 US claimed
US-20080223444-A1 Perylene Charge-Transport Materials, Methods of Fabrication Thereof, and Methods of Use Thereof GEORGIA TECH RESEARCH CORPORATION 2008-09-18 US claimed
WO-2006093965-A2 CORONENE CHARGE-TRANSPORT MATERIALS, METHODS OF FABRICATION THEREOF, AND METHODS OF USE THEREOF GEORGIA TECH RESEARCH CORPORATION (US) 2006-09-08 WO claimed
CN-1247492-C Cobalt catalyst composition for ethylene oligomerization and application thereof CHINA NAT PETROLEUM CORP (CN) 2006-03-29 CN claimed
WO-2005124453-A2 PERYLENE CHARGE-TRANSPORT MATERIALS, METHODS OF FABRICATION THEREOF, AND METHODS OF USE THEREOF GEORGIA TECH RESEARCH CORPORATION (US) 2005-12-29 WO claimed
WO-2005054370-A2 ANTIFOAMING AGENT CLARIANT PRODUKTE (DEUTSCHLAND) GMBH (DE) 2005-06-16 WO claimed
CN-1202049-C Iron-based catalyst composition for ethylene oligomerization and application thereof CHINA NAT PETROLEUM CORP (CN) 2005-05-18 CN claimed
CN-1463800-A Binuclear cobalt catalyst composition for synthesizing linear alpha-olefin by ethylene oligomerization and method for preparing linear alpha-olefin PETROCHINA CO LTD (CN) 2003-12-31 CN claimed
CN-1463799-A Binuclear iron-based catalyst composition for preparing alpha-olefin by ethylene oligomerization and method for preparing linear alpha-olefin PETROCHINA CO LTD (CN) 2003-12-31 CN claimed
CN-1403424-A Cobalt catalyst composition for ethylene oligomerization and preparation method of alpha-olefin CHINA NAT PETROLEUM CORP (CN) 2003-03-19 CN claimed
CN-1374281-A Iron-based catalyst composition for ethylene oligomerization and preparation method of alpha-olefin CHINA PETROLEUM CORP (CN) 2002-10-16 CN 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 (4 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-20240216900-A1 SABRE CATALYSTS CONTAINING FLUORINATED CARBON CHAINS FOR DELIVERY OF METAL-FREE MRI CONTRAST AGENTS FABP7, FFAR1, FABP1 HPGD 2102/4885NPC1 576/4885MAPK1 1878/4885
US-11365168-B2 Preparation of 5-aryl-pentanols HPD, CYP3A5, HTR3C HPGD 83/4885NPC1 2546/4885MAPK1 2130/4885
US-20080223444-A1 Perylene Charge-Transport Materials, Methods of Fabrication Thereof, and Methods of Use Thereof SLC43A1, SLC3A2, SLC16A3 HPGD 2088/4885NPC1 596/4885MAPK1 4724/4885
US-10441946-B2 Linear alpha-olefin catalysts and preparation and use thereof UBE2L3, COG8, ACSL3 HPGD 4597/4885NPC1 3364/4885MAPK1 3056/4885

“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.