SCHEMBL230769

SCHEMBL230769

O=C(CBr)c1ccc(Cl)s1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 5/20 0.68
F2 P00734 1/20 0.57
DAO P14920 1/20 0.57
ALDH1A1 P00352 8/20 0.49
HPGD P15428 5/20 0.49
POLB P06746 3/20 0.49
CASP3 P42574 1/20 0.49
SENP8 Q96LD8 1/20 0.49
SENP7 Q9BQF6 1/20 0.49
SENP6 Q9GZR1 1/20 0.49
KMT2A Q03164 5/20 0.45
MEN1 O00255 4/20 0.45
MAPT P10636 4/20 0.45
KDM4E B2RXH2 2/20 0.45
NPC1 O15118 1/20 0.45
ALOX12 P18054 1/20 0.45
RAB9A P51151 1/20 0.45
HSD17B10 Q99714 1/20 0.45
L3MBTL1 Q9Y468 2/20 0.44
THRB P10828 1/20 0.44

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
SCHEMBL15988636 0.83 GSK3B (0.73) GSK3BF2DAOALDH1A1HPGD
SCHEMBL1985851 0.81 GSK3B (0.70) GSK3BF2DAOALDH1A1HPGD
SCHEMBL3999321 0.81 GSK3B (1.00) GSK3BF2DAOALDH1A1HPGD
SCHEMBL11172498 0.79 GSK3B (0.62) GSK3BF2DAO
SCHEMBL17459466 0.79 GSK3B (0.68) GSK3BF2DAOALDH1A1HPGD
SCHEMBL1359642 0.78 GSK3B (0.67) GSK3BALDH1A1HPGDPOLBKMT2A
SCHEMBL11607360 0.78 GSK3B (0.56) GSK3BDAOALDH1A1HPGDPOLB
SCHEMBL982447 0.78 GSK3B (0.71) GSK3BF2DAOALDH1A1HPGD
SCHEMBL27579199 0.78 GSK3B (0.66) GSK3BF2DAOALDH1A1HPGD
SCHEMBL193501 0.77 GSK3B (1.00) GSK3BDAOALDH1A1HPGDPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2001089447-A2 ANTIFUNGAL SUBSTITUTED PROPYL TRIAZOLE COMPOUND, ITS SALT, AND PREPARATION METHODS THEREOF SECOND MILITARY MEDICAL UNIVERSITY OF PLA. (CN) 2001-11-29 WO claimed
CN-112839942-B 1,3, 4-Oxadiazole derivative compounds as histone deacetylase 6 inhibitors and pharmaceutical compositions containing the same 株式会社 钟根堂 2024-08-23 CN disclosed
US-11958844-B2 1,3,4-oxadiazole derivative compounds as histone deacetylase 6 inhibitor, and pharmaceutical composition comprising the same CHONG KUN DANG PHARMACEUTICAL CORP. (KR) 2024-04-16 US disclosed
EP-3827004-B1 4-(1,3,4-OXADIAZOLE-2-YL)PYRIDINE-2(1H)-ONE DERIVATIVES AS HISTONE DEACETYLASE 6 (HDAC6) INHIBITORS FOR THE TREATMENT OF E.G. INFECTIONS CHONG KUN DANG PHARMACEUTICAL CORP (KR) 2023-10-11 EP disclosed
EP-3827004-B1 4-(1,3,4-OXADIAZOLE-2-YL)PYRIDINE-2(1H)-ONE DERIVATIVES AS HISTONE DEACETYLASE 6 (HDAC6) INHIBITORS FOR THE TREATMENT OF E.G. INFECTIONS CHONG KUN DANG PHARMACEUTICAL CORP (KR) 2023-10-11 EP disclosed
US-20230257395-A1 TETRAZOLE DERIVATIVES AS TRPA1 INHIBITORS BOEHRINGER INGELHEIM INT (DE) 2023-08-17 US disclosed
US-20230257395-A1 TETRAZOLE DERIVATIVES AS TRPA1 INHIBITORS BOEHRINGER INGELHEIM INT (DE) 2023-08-17 US disclosed
US-11661430-B2 Tetrazole derivatives as TRPA1 inhibitors BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2023-05-30 US disclosed
US-11661427-B2 Tetrazole derivatives as TRPA1 inhibitors BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2023-05-30 US disclosed
US-11661427-B2 Tetrazole derivatives as TRPA1 inhibitors BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2023-05-30 US disclosed
EP-0641794-A1 Thienyl- and furylpyrrole derivatives, their preparation and their use as insecticides and acaricides AMERICAN CYANAMID COMPANY (US) 1995-03-08 EP disclosed
EP-0436736-B1 THERMAL TRANSFER SHEET DAI NIPPON INSATSU KABUSHIKI KAISHA (JP) 1993-04-28 EP disclosed
US-5187145-A Imidazole dye derivatives DAI NIPPON INSATSU KABUSHIKI KAISHA (JP) 1993-02-16 US disclosed
EP-0436736-A1 THERMAL TRANSFER SHEET DAI NIPPON INSATSU KABUSHIKI KAISHA (JP) 1991-07-17 EP disclosed
US-4492695-A ANTICONVULSANTS, SEDATIVES, TRANQUILIZERS SYNTHELABO (FR) 1985-01-08 US disclosed
EP-0097480-A1 Triazole antifungal agents Pfizer Limited (GB) 1984-01-04 EP disclosed
US-4105663-A HYPOTENSIVE, BLOCKING AGENTS AMERICAN HOME PRODUCTS CORPORATION (US) 1978-08-08 US disclosed
US-4093628-A HYPOTENSIVE AGENTS, BLOCKING AGENTS AMERICAN HOME PRODUCTS CORPORATION (US) 1978-06-06 US disclosed
US-4017631-A MICROBIOCIDES JANSSEN PHARMACEUTICA N.V. (BE) 1977-04-12 US disclosed
US-3991202-A ANTIMICROBIALS JANSSEN PHARMACEUTICA N.V. (BE) 1976-11-09 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 (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-20230257395-A1 TETRAZOLE DERIVATIVES AS TRPA1 INHIBITORS TRPA1, TRPV1, TRPV5 GSK3B 3802/4885F2 4735/4885DAO 1811/4885
US-11958844-B2 1,3,4-oxadiazole derivative compounds as histone deacetylase 6 inhibitor, and pharmaceutical composition comprising the same HDAC6, HDAC1, HDAC3 GSK3B 180/4885F2 4806/4885DAO 2675/4885
US-11661427-B2 Tetrazole derivatives as TRPA1 inhibitors TRPA1, TRPV1, TRPV5 GSK3B 3864/4885F2 4744/4885DAO 1673/4885
US-11661430-B2 Tetrazole derivatives as TRPA1 inhibitors TRPA1, TRPV1, TRPV5 GSK3B 3864/4885F2 4744/4885DAO 1673/4885

“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.