SCHEMBL612535

SCHEMBL612535

Nc1cc(S)ccc1[N+](=O)[O-]

nearest known ligand 0.64

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 4/20 0.64
▸ TSHR P16473 3/20 0.64
▸ MAPK1 P28482 1/20 0.53
▸ MAPT P10636 7/20 0.50
▸ LMNA P02545 3/20 0.50
▸ ALDH1A1 P00352 3/20 0.50
▸ MEN1 O00255 2/20 0.48
▸ POLB P06746 2/20 0.48
▸ KMT2A Q03164 2/20 0.48
▸ CYP3A4 P08684 2/20 0.48
▸ ALOX15 P16050 1/20 0.48
▸ RECQL P46063 2/20 0.46
▸ SIRT6 Q8N6T7 1/20 0.46
▸ MCL1 Q07820 1/20 0.43
▸ L3MBTL1 Q9Y468 1/20 0.43
▸ PDE7A Q13946 2/20 0.42
▸ CASP6 P55212 1/20 0.41

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
SCHEMBL9285883 0.83 TDP1 (0.64) TDP1TSHRMAPTLMNAALDH1A1
Fluoride SCHEMBL28506026 0.82 MAPT (0.62) TDP1TSHRMAPTLMNAALDH1A1
SCHEMBL28621447 0.82 TDP1 (0.62) TDP1TSHRMAPTLMNAALDH1A1
SCHEMBL3973537 0.78 MAPT (0.69) TDP1TSHRMAPK1MAPTLMNA
SCHEMBL29378383 0.78 TDP1 (1.00) TDP1TSHRMAPK1MAPTLMNA
SCHEMBL121896 0.78 TDP1 (1.00) TDP1TSHRMAPK1MAPTLMNA
SCHEMBL7058241 0.77 MAPT (0.47) TDP1TSHRMAPTLMNAALDH1A1
SCHEMBL31553358 0.77 TDP1 (0.73) TDP1TSHRMAPK1MAPTALDH1A1
SCHEMBL2867570 0.77 TDP1 (0.73) TDP1TSHRMAPK1MAPTALDH1A1
Hydrochloric Acid SCHEMBL28403392 0.77 TDP1 (0.96) TDP1TSHRMAPK1MAPTLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108299259-B Preparation method of 2-amino-5-thiophenyl- (2-methoxy) acetanilide 珠海优润医药科技有限公司 2020-08-07 — — CN claimed
CN-108299259-A The preparation method of 2- amino -5- thiophenyls-(2- methoxyl groups) antifebrin 珠海优润医药科技有限公司 2018-07-20 — — CN claimed
CN-116496192-B Preparation method of 4-phenylthio-1, 2-phenylenediamine 山东国邦药业有限公司 2023-09-19 — — CN disclosed
CN-116496192-A Preparation method of 4-phenylthio-1, 2-phenylenediamine 山东国邦药业有限公司 2023-07-28 — — CN disclosed
CN-114716354-B Synthesis method of fenbendazole intermediate 2-nitro-4-thiophenylaniline 山东国邦药业有限公司 2022-08-09 — — CN disclosed
CN-114716354-A Synthesis method of fenbendazole intermediate 2-nitro-4-thiophenyl aniline 山东国邦药业有限公司 2022-07-08 — — CN disclosed
CN-108299259-B Preparation method of 2-amino-5-thiophenyl- (2-methoxy) acetanilide 珠海优润医药科技有限公司 2020-08-07 — — CN disclosed
CN-108299259-B Preparation method of 2-amino-5-thiophenyl- (2-methoxy) acetanilide 珠海优润医药科技有限公司 2020-08-07 — — CN disclosed
CN-108299259-A The preparation method of 2- amino -5- thiophenyls-(2- methoxyl groups) antifebrin 珠海优润医药科技有限公司 2018-07-20 — — CN disclosed
US-9321777-B2 6-triazolopyridazine sulfanyl benzothiazole derivatives as MET inhibitors SANOFI (FR) 2016-04-26 — — US disclosed
US-9321777-B2 6-triazolopyridazine sulfanyl benzothiazole derivatives as MET inhibitors SANOFI (FR) 2016-04-26 — — US disclosed
EP-2178881-A2 NOVEL 6-TRIAZOLOPYRIDAZINESULFANYL BENZOTHIAZOLE AND BENZIMIDAZOLE DERIVATIVES, METHOD FOR PRODUCTION THEREOF AND APPLICATION AS MEDICAMENTS AND PHARMACEUTICAL COMPOSITIONS AND NOVEL USE AS MET INHIBITORS Sanofi-Aventis (FR) 2010-04-28 — — EP disclosed
WO-2009056692-A2 NOVEL 6-TRIAZOLOPYRIDAZINESULFANYL BENZOTHIAZOLE AND BENZIMIDAZOLE DERIVATIVES, METHOD FOR PRODUCTION THEREOF AND APPLICATION AS MEDICAMENTS AND PHARMACEUTICAL COMPOSITIONS AND NOVEL USE AS MET INHIBITORS SANOFI-AVENTIS (FR) 2009-05-07 — — WO disclosed
WO-2009056692-A2 NOVEL 6-TRIAZOLOPYRIDAZINESULFANYL BENZOTHIAZOLE AND BENZIMIDAZOLE DERIVATIVES, METHOD FOR PRODUCTION THEREOF AND APPLICATION AS MEDICAMENTS AND PHARMACEUTICAL COMPOSITIONS AND NOVEL USE AS MET INHIBITORS SANOFI-AVENTIS (FR) 2009-05-07 — — WO disclosed
US-4156006-A ANTHELMINTICS E. R. SQUIBB & SONS, INC. (US) 1979-05-22 — — US disclosed
US-4080461-A PESTICIDES, FUNGICIDES SYNTEX (U.S.A.) INC. (US) 1978-03-21 — — US disclosed
US-4072696-A 5(6)-Benzene ring substituted benzimidazole-2-carbamate derivatives having anthelmintic activity SYNTEX (U.S.A.) INC. (US) 1978-02-07 — — US disclosed
US-4005202-A 5(6)-Benzene ring substituted benzimidazole-2-carbamate derivatives having anthelmintic activity SYNTEX (U.S.A.) INC. (US) 1977-01-25 — — US disclosed
US-4002640-A ANTIFUNGAL AGENTS SYNTEX (U.S.A.) INC. (US) 1977-01-11 — — US disclosed
US-3935209-A 5(6)-Benzene ring substituted benzimidazole-2-carbamate derivatives having anthelmintic activity SYNTEX (U.S.A.) INC. (US) 1976-01-27 — — US disclosed
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