Sugi Predict

Sugi Predict / Compounds / SCHEMBL6301628

SCHEMBL6301628

SCHEMBL6301628

CCCCCc1ccc(Cn2c(C)nc3ccc(C(=O)O)cc32)c(Cl)c1

nearest known ligand 0.59

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ PPARG P37231 1/20 0.59
▸ AGTR1 P30556 11/20 0.51
▸ AGTR2 P50052 11/20 0.51
▸ PLA2G4A P47712 2/20 0.43
▸ DCTPP1 Q9H773 1/20 0.42
▸ RARB P10826 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 0.99 PPARG (0.58) PPARGAGTR1AGTR2PLA2G4ARARB
SCHEMBL6301197 0.99 PPARG (0.58) PPARGAGTR1AGTR2PLA2G4ARARB
SCHEMBL6303561 0.97 PPARG (0.57) PPARGAGTR1AGTR2
SCHEMBL6307861 0.90 PPARG (0.56) PPARGAGTR1AGTR2DCTPP1
SCHEMBL6309647 0.89 PPARG (0.54) PPARGAGTR1AGTR2DCTPP1
SCHEMBL6308739 0.89 PPARG (0.56) PPARGAGTR1AGTR2
SCHEMBL6309536 0.89 PPARG (0.56) PPARGAGTR1AGTR2
SCHEMBL7651458 0.86 PPARG (0.56) PPARGAGTR1AGTR2DCTPP1
SCHEMBL6301607 0.85 PPARG (0.58) PPARGAGTR1AGTR2PLA2G4ARARB
SCHEMBL6301327 0.85 PPARG (0.83) PPARGAGTR1AGTR2

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