SCHEMBL276957

SCHEMBL276957

Oc1occ2ccccc12

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.42
PTPN22 Q9Y2R2 1/20 0.39
TRPM4 Q8TD43 1/20 0.39
HSD17B10 Q99714 2/20 0.39
ALDH1A1 P00352 2/20 0.39
CYP2A6 P11509 2/20 0.39
TSHR P16473 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
NQO2 P16083 1/20 0.38
IDO1 P14902 1/20 0.38
POLB P06746 1/20 0.37
HPRT1 P00492 1/20 0.36
USP2 O75604 1/20 0.35
PAK1 Q13153 1/20 0.35
CYP2C9 P11712 1/20 0.35
CYP2C19 P33261 1/20 0.35
GPR84 Q9NQS5 1/20 0.34
ALOX12 P18054 1/20 0.33
LDHA P00338 1/20 0.33
KDM4E B2RXH2 1/20 0.33

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
SCHEMBL28471616 0.70 ALDH1A1 (0.39) CYP1A2PTPN22TRPM4HSD17B10ALDH1A1
SCHEMBL1097671 0.70 CYP2A6 (0.42) CYP1A2HSD17B10ALDH1A1CYP2A6TSHR
SCHEMBL276956 0.70 ALDH1A1 (0.39) CYP1A2HSD17B10ALDH1A1CYP2A6TSHR
SCHEMBL1605255 0.70 ALDH1A1 (0.39) CYP1A2PTPN22HSD17B10ALDH1A1CYP2A6
SCHEMBL2008998 0.70 ALDH1A1 (0.42) CYP1A2HSD17B10ALDH1A1CYP2A6TSHR
SCHEMBL4079696 0.70 CYP2A6 (0.42) CYP1A2HSD17B10ALDH1A1CYP2A6TSHR
SCHEMBL4897405 0.70 ALDH1A1 (0.39) CYP1A2PTPN22TRPM4HSD17B10ALDH1A1
SCHEMBL286416 0.70 ALDH1A1 (0.39) CYP1A2TRPM4HSD17B10ALDH1A1CYP2A6
SCHEMBL21179481 0.70 ALDH1A1 (0.39) CYP1A2PTPN22HSD17B10ALDH1A1CYP2A6
SCHEMBL2012336 0.70 ALDH1A1 (0.39) CYP1A2PTPN22TRPM4HSD17B10ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0420570-A2 Trans 2,3-disubstituted-2,3-dihydro-5-hydroxy-benzofurans as inhibitors of leukotriene biosynthesis MERCK & CO. INC. (US) 1991-04-03 EP claimed
CN-119192108-B Preparation method of chiral phthaloyl ester prodrug 贵州大学 2026-05-01 CN disclosed
CN-119192108-A Preparation method of chiral phthaloyl ester prodrug 贵州大学 2024-12-27 CN disclosed
EP-4479054-A1 COMPOUNDS, COMPOSITIONS, AND METHODS Nico Therapeutics, Inc. (US) 2024-12-25 EP disclosed
CN-118373791-A Allyl phthalide compound and preparation method and application thereof 南京工业大学 2024-07-23 CN disclosed
CN-118373791-A Allyl phthalide compound and preparation method and application thereof 南京工业大学 2024-07-23 CN disclosed
CN-117800924-A Synthesis method of PARP inhibitor intermediate 南京江原安迪科正电子研究发展有限公司 2024-04-02 CN disclosed
CN-114950505-B Catalyst for preparing beta-phenethyl alcohol by hydrogenation of styrene oxide, and preparation method and application thereof 浙江大学 2023-11-24 CN disclosed
WO-2023158708-A1 COMPOUNDS, COMPOSITIONS, AND METHODS DENALI THERAPEUTICS INC. (US) 2023-08-24 WO disclosed
US-11174272-B2 1-arylcarbonyl-4-oxy-piperidine compounds useful for the treatment of neurodegenerative diseases TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2021-11-16 US disclosed
US-4341793-A HYPOGLYCEMIC AGENTS AND DIETETICS BEECHAM GROUP LIMITED (GB) 1982-07-27 US disclosed
US-4301292-A 1-[2-(4,5-Dihydro-4,4-dialkyl-2-oxazolyl)phenyl]-4-(dialkylamino)cyclohexanol HOECHST-ROUSSEL PHARMACEUTICALS, INCORPORATED (US) 1981-11-17 US disclosed
US-4292243-A 3\"-Phenyldispiro[1,3-dioxolane-2,4'-cyclohexane-1',1\"-(3\"H)-isobenzofuran] HOECHST ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1981-09-29 US disclosed
US-4292245-A 3'-Phenylspiro[cyclohexane-1,1'(3'H)-isobenzofuran]-4-one HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1981-09-29 US disclosed
US-4290958-A Spiro[cyclohexane-1,1'(3'H)-isobenzofuran]s HOECHST-ROUSSEL PHARMACEUTICALS, INC. (US) 1981-09-22 US disclosed
US-4288623-A 1-Aryl-4-amino-cyclohexan-1-ols HOECHST-ROUSSEL PHARMACEUTICALS INC. (US) 1981-09-08 US disclosed
EP-0029320-A2 Secondary ethanol amines, their preparation and their use in pharmaceutical compositions BEECHAM GROUP PLC (GB) 1981-05-27 EP disclosed
EP-0027522-A1 Spiro(cyclohexane-1,1'(3'H)-isobenzofuran)s, processes and intermediates for their preparation and pharmaceutical compositions containing them HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1981-04-29 EP disclosed
US-4263317-A Spiro[cyclohexane-1,1'(3'H)-isobenzofuran]s HOECHST-ROUSSEL PHARMACEUTICALS, INC. (US) 1981-04-21 US disclosed
US-4032656-A ANTIPROSTAGLANDIN ACTIVITY, ANTIDIARRHEA AGENTS SMITHKLINE CORPORATION (US) 1977-06-28 US disclosed

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

For each of this compound's patents that has machine-readable text (1 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-11174272-B2 1-arylcarbonyl-4-oxy-piperidine compounds useful for the treatment of neurodegenerative diseases SNCA, HTT, PSEN1 CYP1A2 3436/4885PTPN22 2021/4885TRPM4 1526/4885

“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.