SCHEMBL27524156

SCHEMBL27524156

Cc1nc2ccc(C(=O)N(CCC(C)C)[SH](=O)=O)cc2n1Cc1ccccc1Cl

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ PPARG P37231 2/20 0.47
▸ ALOX5AP P20292 3/20 0.44
▸ ALDH1A1 P00352 1/20 0.42
▸ MAPT P10636 1/20 0.42
▸ SMN1; SMN2 Q16637 1/20 0.42
▸ MC4R P32245 9/20 0.41
▸ MC5R P33032 1/20 0.41
▸ MC3R P41968 1/20 0.41
▸ MC1R Q01726 1/20 0.41
▸ TDP1 Q9NUW8 1/20 0.40
▸ TNF P01375 1/20 0.40
▸ TP53 P04637 1/20 0.39
▸ HRH3 Q9Y5N1 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
SCHEMBL27491510 0.86 PPARG (0.45) PPARGALOX5APALDH1A1MAPTSMN1; SMN2
SCHEMBL27449185 0.81 PPARG (0.53) PPARGALOX5APALDH1A1SMN1; SMN2MC4R
SCHEMBL27465432 0.81 PPARG (0.53) PPARGALOX5APSMN1; SMN2MC4RMC5R
SCHEMBL27450180 0.81 PPARG (0.53) PPARGALOX5APSMN1; SMN2MC4RMC5R
SCHEMBL27449649 0.79 PPARG (0.48) PPARGMC4RMC5RMC3RMC1R
SCHEMBL6169166 0.79 PPARG (0.57) PPARGALOX5APALDH1A1MAPTSMN1; SMN2
SCHEMBL1178714 0.78 PPARG (0.64) PPARGALOX5APALDH1A1MAPTSMN1; SMN2
SCHEMBL27506551 0.78 PPARG (0.45) PPARGALOX5APALDH1A1MAPTSMN1; SMN2
SCHEMBL27450620 0.77 PPARG (0.55) PPARGALOX5APALDH1A1MAPTSMN1; SMN2
SCHEMBL27508179 0.76 PPARG (0.55) PPARGALDH1A1MAPTSMN1; SMN2TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1211238-A Benzimidazole derivatives FUJISAWA PHARMACEUTICAL CO (JP) 1999-03-17 — — CN disclosed
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