SCHEMBL632443

SCHEMBL632443

O=Cc1ccc2sccc2c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CYP2A6 P11509 7/20 1.00
ALDH1A1 P00352 1/20 0.43
DYRK1A Q13627 1/20 0.42
PTPRC P08575 1/20 0.41
PTPN6 P29350 1/20 0.41
PTPN11 Q06124 1/20 0.41
PTPN22 Q9Y2R2 1/20 0.41
CTNNB1 P35222 1/20 0.40
WNT3A P56704 1/20 0.40
CA2 P00918 6/20 0.40
CA12 O43570 5/20 0.39
KDM4E B2RXH2 1/20 0.39
PTGS2 P35354 1/20 0.39
RAB9A P51151 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
SCHEMBL29952287 1.00 CYP2A6 (1.00) CYP2A6ALDH1A1DYRK1APTPRCPTPN6
SCHEMBL1894396 0.83 CYP2A6 (0.71) CYP2A6ALDH1A1KDM4EPTGS2RAB9A
SCHEMBL9432076 0.83 CYP2A6 (0.70) CYP2A6ALDH1A1DYRK1APTPRCPTPN6
SCHEMBL2825533 0.81 CYP2A6 (0.67) CYP2A6ALDH1A1DYRK1ACA2CA12
SCHEMBL6598547 0.79 CYP2A6 (0.66) CYP2A6ALDH1A1DYRK1APTPRCPTPN6
SCHEMBL13177010 0.79 CYP2A6 (0.66) CYP2A6ALDH1A1DYRK1APTPRCPTPN6
SCHEMBL27727596 0.79 CYP2A6 (0.66) CYP2A6ALDH1A1DYRK1APTPRCPTPN6
SCHEMBL20759181 0.76 CYP2A6 (0.57) CYP2A6CA2CA12RAB9A
SCHEMBL16693049 0.75 CYP2A6 (0.59) CYP2A6ALDH1A1DYRK1APTPRCPTPN6
SCHEMBL9798820 0.73 CYP2A6 (0.57) CYP2A6PTPRCPTPN6PTPN11PTPN22

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106459062-A Substituted [1,2,4] triazolo [1,5-a ] pyrimidin-7-yl compounds as PDE2 inhibitors 达特神经科学(开曼)有限公司 2017-02-22 CN claimed
CN-104774319-B Bis(benzothiophene) ethylene polymers and preparation method and application thereof 中国科学院化学研究所 2017-02-01 CN claimed
CN-104774319-A Bis(benzothiophene) ethylene polymers and preparation method and application thereof CHINESE ACAD INST CHEMISTRY 2015-07-15 CN claimed
CN-1255119-A Protease inhibitors SMITHKLINE BEECHAM CORP (US) 2000-05-31 CN claimed
US-20250270210-A1 BCL-2 Inhibitor BEIGENE, LTD. (KY) 2025-08-28 US disclosed
US-12286430-B2 Bcl-2 inhibitor BEIGENE, LTD. (KY) 2025-04-29 US disclosed
US-20240376097-A1 BCL-2 Inhibitor BEIGENE LTD. (KY) 2024-11-14 US disclosed
CN-116969936-A BCL-2 inhibitors 百济神州有限公司 2023-10-31 CN disclosed
CN-116969937-A BCL-2 inhibitors 百济神州有限公司 2023-10-31 CN disclosed
CN-116802179-A BCL-2 inhibitors 百济神州有限公司 2023-09-22 CN disclosed
US-11673885-B2 γ-diketones as Wnt/β-catenin signaling pathway activators BIOSPLICE THERAPEUTICS, INC. (US) 2023-06-13 US disclosed
US-11673885-B2 γ-diketones as Wnt/β-catenin signaling pathway activators BIOSPLICE THERAPEUTICS, INC. (US) 2023-06-13 US disclosed
EP-0129478-B1 2-SULFAMOYLBENZO (B) THIOPHENE DERIVATIVES, THEIR PREPARATION AND PHARMACEUTICAL COMPOSITION FOR THE TREATMENT OF ELEVATED INTRAOCULAR PRESSURE MERCK & CO. INC. (US) 1990-01-17 EP disclosed
US-4788192-A TOPICALLY APPLYING; FOR GLAUCOMA MERCK & CO., INC. (US) 1988-11-29 US disclosed
US-4668697-A Elevated intraocular pressure lowering benzo-[b]-thiophene-2-sulfonamide derivatives, compositions, and method of use therefor MERCK & CO., INC. (US) 1987-05-26 US disclosed
US-4664693-A POSTEMERGENCE ICI AUSTRALIA LIMITED (AU) 1987-05-12 US disclosed
US-4611059-A THROMBOXANE A2(TXA2) SYNTHETASE INHIBITORS THE UPJOHN COMPANY (US) 1986-09-09 US disclosed
EP-0129478-A2 2-Sulfamoylbenzo (b) thiophene derivatives, their preparation and pharmaceutical composition for the treatment of elevated intraocular pressure MERCK & CO. INC. (US) 1984-12-27 EP disclosed
EP-0125059-A2 Herbicidal cyclohexane-1,3-dione derivatives ICI AUSTRALIA LIMITED (AU) 1984-11-14 EP disclosed
EP-0069521-A2 Pyridinyl and imidazolyl derivatives of benzofurans and benzothiophenes THE UPJOHN COMPANY (US) 1983-01-12 EP 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 (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-20250270210-A1 BCL-2 Inhibitor BCL2, BCL2A1, BCL2L1 CYP2A6 3337/4885ALDH1A1 2918/4885DYRK1A 2763/4885
US-20240376097-A1 BCL-2 Inhibitor BCL2, BCL2A1, BCL2L1 CYP2A6 3337/4885ALDH1A1 2918/4885DYRK1A 2763/4885
US-12286430-B2 Bcl-2 inhibitor BCL2, BCL2A1, BCL2L1 CYP2A6 3337/4885ALDH1A1 2918/4885DYRK1A 2763/4885
US-11673885-B2 γ-diketones as Wnt/β-catenin signaling pathway activators GSK3A, GSK3B, WNT1 CYP2A6 2198/4885ALDH1A1 1093/4885DYRK1A 693/4885

“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.