SCHEMBL27580004

SCHEMBL27580004

Cc1ccc(N[SH](=O)=O)c(C)c1C

nearest known ligand 0.32

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TDP2 O95551 1/20 0.32
▸ NSD2 O96028 1/20 0.32
▸ HSP90AA1 P07900 1/20 0.32
▸ PAX8 Q06710 1/20 0.32
▸ METAP2 P50579 1/20 0.32
▸ KEAP1 Q14145 1/20 0.31
▸ NFE2L2 Q16236 1/20 0.31
▸ MEN1 O00255 1/20 0.31
▸ AKR1B10 O60218 1/20 0.31
▸ TRPA1 O75762 1/20 0.31
▸ ABCB11 O95342 1/20 0.31
▸ DHFR P00374 1/20 0.31
▸ LMNA P02545 1/20 0.31
▸ MPO P05164 1/20 0.31
▸ CYP1A2 P05177 1/20 0.31
▸ CYP3A4 P08684 1/20 0.31
▸ CHRM1 P11229 1/20 0.31
▸ CYP2C9 P11712 1/20 0.31
▸ AKR1B1 P15121 1/20 0.31
▸ PTGS1 P23219 1/20 0.31

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
SCHEMBL1335872 0.72 KMT2A (0.44) TDP2NSD2HSP90AA1PAX8METAP2
SCHEMBL15020369 0.71 SMN1; SMN2 (0.50) MEN1LMNAKMT2A
SCHEMBL15919625 0.71 GAA (0.50) MEN1LMNACYP1A2CYP2C9KMT2A
SCHEMBL18461006 0.70 IDO1 (0.33) TDP2NSD2HSP90AA1PAX8METAP2
SCHEMBL14476760 0.70 NPC1 (0.50) LMNATDP1
SCHEMBL14624383 0.69 AKR1C3 (0.50) MEN1LMNAAKR1C3KMT2A
SCHEMBL3700950 0.69 POLB (0.33) TDP2NSD2HSP90AA1PAX8METAP2
SCHEMBL18780754 0.68 ALDH1A1 (0.46) KEAP1MEN1LMNACYP1A2CYP3A4
SCHEMBL15176963 0.68 NOX1 (0.49) MEN1LMNAKMT2ATDP1
SCHEMBL15087203 0.68 MAPT (0.47) MEN1LMNACYP1A2CYP3A4CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1361663-A Fungicidal combinations of active substances BAYER AG (DE) 2002-07-31 — — CN claimed
CN-110382634-A Composition 佐敦有限公司 2019-10-25 — — CN disclosed
CN-110366582-A Composition 佐敦有限公司 2019-10-22 — — CN disclosed
CN-109983083-A Antifouling composition 佐敦有限公司 2019-07-05 — — CN disclosed
CN-109777178-A Antifouling composition 佐敦有限公司 2019-05-21 — — CN disclosed
CN-109777298-A Antifouling paint compositions 佐敦有限公司 2019-05-21 — — CN disclosed
CN-105165883-B Fungicidal mixture based on azoles and pyrimidine radicals amine 巴斯夫欧洲公司 2018-01-30 — — CN disclosed
CN-104703982-B Pyrazole compound and the pesticide combination comprising pyrazole compound 巴斯夫欧洲公司 2018-01-05 — — CN disclosed
CN-105050406-B Composition comprising triazole compound 巴斯夫农业公司 2017-09-15 — — CN disclosed
CN-107075712-A Non-amphoteric, quaternizable and water-soluble polymers for modifying the surface charge of solid particles 巴斯夫欧洲公司 2017-08-18 — — CN disclosed
CN-101247723-A Fungicide mixtures based on 3-monosubstituted pyrazole carboxylic acid biphenyl amides BASF SE (DE) 2008-08-20 — — CN disclosed
CN-101232814-A Fungicidal mixtures based on azolopyrimidinylamines BASF SE (DE) 2008-07-30 — — CN disclosed
CN-101217873-A Fungicidal mixtures made from 1-methylpyrazol-4-ylcarboxanilides BASF AG (DE) 2008-07-09 — — CN disclosed
CN-101212902-A Fungicidal mixtures based on 3, 5-disubstituted pyrazole carboxylic acid biphenylamides BASF AG (DE) 2008-07-02 — — CN disclosed
CN-101212901-A Fungicidal mixtures based on 2,5-disubstituted pyrazol carboxylic acid biphenylamides BASF AG (DE) 2008-07-02 — — CN disclosed
CN-101212900-A Fungicide mixtures based on 2,4-disubstituted pyrazole carboxylic acid biphenylamides BASF AG (DE) 2008-07-02 — — CN disclosed
CN-101087524-A Fungicidal mixtures BASF AG (DE) 2007-12-12 — — CN disclosed
CN-101087529-A Fungicidal mixtures BASF AG (DE) 2007-12-12 — — CN disclosed
CN-101087530-A Fungicidal mixtures BASF AG (DE) 2007-12-12 — — CN disclosed
CN-1361663-A Fungicidal combinations of active substances BAYER AG (DE) 2002-07-31 — — CN disclosed
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