SCHEMBL6301197

SCHEMBL6301197

CCCCCCc1ccc(Cn2c(C)nc3ccc(C(=O)O)cc32)c(Cl)c1

nearest known ligand 0.58

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PPARG P37231 1/20 0.58
AGTR1 P30556 8/20 0.50
AGTR2 P50052 8/20 0.50
PLA2G4A P47712 2/20 0.44
RARB P10826 5/20 0.43
MEN1 O00255 1/20 0.42
ALDH1A1 P00352 1/20 0.42
RARA P10276 1/20 0.42
MAPT P10636 1/20 0.42
MTOR P42345 1/20 0.42
KMT2A Q03164 1/20 0.42

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
SCHEMBL6301633 1.00 PPARG (0.58) PPARGAGTR1AGTR2PLA2G4ARARB
SCHEMBL6301628 0.99 PPARG (0.59) PPARGAGTR1AGTR2PLA2G4ARARB
SCHEMBL6303561 0.96 PPARG (0.57) PPARGAGTR1AGTR2
SCHEMBL6309536 0.90 PPARG (0.56) PPARGAGTR1AGTR2MEN1ALDH1A1
SCHEMBL6308739 0.90 PPARG (0.56) PPARGAGTR1AGTR2MEN1ALDH1A1
SCHEMBL6307861 0.89 PPARG (0.56) PPARGAGTR1AGTR2MEN1ALDH1A1
SCHEMBL6309647 0.88 PPARG (0.54) PPARGAGTR1AGTR2
SCHEMBL27465431 0.86 PPARG (0.52) PPARGAGTR1AGTR2
SCHEMBL6303646 0.86 PPARG (0.57) PPARGAGTR1AGTR2PLA2G4ARARB
SCHEMBL6308005 0.86 PPARG (0.57) PPARGAGTR1AGTR2PLA2G4ARARB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6869950-B1 Benzimidazole derivatives FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2005-03-22 US disclosed
EP-1142880-A1 BENZIMIDAZOLE DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2001-10-10 EP disclosed