SCHEMBL8799762

SCHEMBL8799762

CCc1nc(C)sc1C(=O)NC(C#N)c1ccco1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.39
KMT2A Q03164 4/20 0.39
RAB9A P51151 3/20 0.39
NPC1 O15118 2/20 0.39
ALDH1A1 P00352 5/20 0.38
LMNA P02545 1/20 0.38
MAPT P10636 1/20 0.38
HPGD P15428 2/20 0.37
TSHR P16473 2/20 0.37
HSD17B10 Q99714 2/20 0.37
KDM4E B2RXH2 2/20 0.37
NPSR1 Q6W5P4 2/20 0.36
HTT P42858 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
CTSV O60911 1/20 0.36
CTSL P07711 1/20 0.36
CTSB P07858 1/20 0.36
CTSS P25774 1/20 0.36
CTSK P43235 1/20 0.36

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
SCHEMBL9532579 0.89 RAB9A (0.37) MEN1KMT2ARAB9ANPC1ALDH1A1
SCHEMBL8799757 0.86 LMNA (0.51) MEN1KMT2ARAB9ANPC1ALDH1A1
SCHEMBL8799758 0.82 CTSV (0.33) MEN1KMT2ARAB9ANPC1ALDH1A1
SCHEMBL8798660 0.80 RAB9A (0.39) MEN1KMT2ARAB9ANPC1ALDH1A1
SCHEMBL9755465 0.79 HSD11B1 (0.36) MEN1KMT2ARAB9ANPC1ALDH1A1
SCHEMBL9528349 0.79 ALDH1A1 (0.51) MEN1KMT2ARAB9AALDH1A1LMNA
SCHEMBL8800994 0.78 S1PR1 (0.36) MEN1KMT2ARAB9ANPC1ALDH1A1
SCHEMBL9369386 0.72 RAB9A (0.38) MEN1KMT2ARAB9ANPC1ALDH1A1
SCHEMBL10431200 0.72 CTSV (0.35) NPC1CTSVCTSLCTSBCTSS
SCHEMBL10665838 0.72 CTSV (0.46) MEN1KMT2ARAB9ANPC1ALDH1A1

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0517476-B1 Benzimidazole derivatives, a method for producing the same, agricultural and horticultural fungicides containing the same as an active ingredient and intermediate compounds thereof SUMITOMO CHEMICAL CO (JP) 1997-10-08 EP claimed
EP-0517476-A2 Benzimidazole derivatives, a method for producing the same, agricultural and horticultural fungicides containing the same as an active ingredient and intermediate compounds thereof SUMITOMO CHEMICAL COMPANY LIMITED (JP) 1992-12-09 EP claimed
EP-0517476-B1 Benzimidazole derivatives, a method for producing the same, agricultural and horticultural fungicides containing the same as an active ingredient and intermediate compounds thereof SUMITOMO CHEMICAL CO (JP) 1997-10-08 EP disclosed
US-5472974-A Benzimidazole derivatives, agricultural and horticultural fungicides containing the same as an active ingredient and intermediate compounds thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1995-12-05 US disclosed
US-5395952-A Nonphytotoxic SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1995-03-07 US disclosed
EP-0292937-B1 Amide derivatives, and their production and agricultural fungicides containing them SUMITOMO CHEMICAL CO (JP) 1994-08-10 EP disclosed
US-5310747-A Benzimidazole derivatives, agricultural and horticultural fungicides containing the same as an active ingredient and intermediate compounds thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1994-05-10 US disclosed
EP-0517476-A2 Benzimidazole derivatives, a method for producing the same, agricultural and horticultural fungicides containing the same as an active ingredient and intermediate compounds thereof SUMITOMO CHEMICAL COMPANY LIMITED (JP) 1992-12-09 EP disclosed
US-4918089-A THIAZOLE DERIVATIVES; CURATIVE, NONPHYTOTOXIC SUMITOMO CHEMICAL COMPANY LIMITED (JP) 1990-04-17 US disclosed