SCHEMBL7196842

SCHEMBL7196842

CCCCCOc1ccc(Cn2c(C)nc3ccc(OCCCCC(CC)C(=O)O)cc32)c(Cl)c1

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PPARG P37231 4/20 0.47
ALOX5AP P20292 4/20 0.40
PTGES O14684 1/20 0.37
ALOX5 P09917 1/20 0.37
THRB P10828 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
KDM4E B2RXH2 1/20 0.37
DCTPP1 Q9H773 1/20 0.36
PDE2A O00408 3/20 0.36
THRA P10827 1/20 0.36
MAPT P10636 2/20 0.35
S1PR1 P21453 1/20 0.35
S1PR5 Q9H228 1/20 0.35
LMNA P02545 1/20 0.35
TP53 P04637 1/20 0.35
ACSS2 Q9NR19 1/20 0.35
PPARA Q07869 2/20 0.35
PPARD Q03181 1/20 0.35
ALDH1A1 P00352 1/20 0.35

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
SCHEMBL7199168 0.98 PPARG (0.47) PPARGALOX5APPTGESALOX5THRB
SCHEMBL7197576 0.90 PPARG (0.44) PPARGALOX5APPTGESALOX5THRB
SCHEMBL6498744 0.87 PPARG (0.51) PPARGALOX5APTHRBDCTPP1PDE2A
SCHEMBL6491422 0.87 PPARG (0.51) PPARGALOX5APTHRBPDE2ATHRA
SCHEMBL6492145 0.87 PPARG (0.51) PPARGALOX5APTHRBPDE2ATHRA
SCHEMBL6487612 0.87 PPARG (0.51) PPARGALOX5APACSS2
SCHEMBL7194187 0.86 PPARG (0.40) PPARGALOX5APPTGESALOX5THRB
SCHEMBL7194795 0.86 PPARG (0.40) PPARGPTGESALOX5THRBSMN1; SMN2
SCHEMBL6500098 0.86 PPARG (0.50) PPARGALOX5APTHRBPDE2ATHRA
SCHEMBL6301607 0.86 PPARG (0.58) PPARGTP53

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
WO-2004108686-A2 BENZIMIDAZOLE COMPOUNDS HAVING HYPOGLYCEMIC ACTIVITY FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-12-16 WO disclosed