SCHEMBL8905753

SCHEMBL8905753

CCc1nc2ccc(-c3ccc(=O)[nH]n3)cc2n1-c1ccc(-c2ccccc2)c(C(=O)O)c1C

nearest known ligand 0.41

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 1/20 0.41
CYP1A2 P05177 1/20 0.37
PPARG P37231 9/20 0.36
DHODH Q02127 2/20 0.34
MEN1 O00255 1/20 0.34
LMNA P02545 1/20 0.34
KMT2A Q03164 1/20 0.34

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
SCHEMBL8905970 0.94 PPARG (0.41) GPR119PPARG
SCHEMBL8906575 0.93 AGTR2 (0.41) PPARG
SCHEMBL8906411 0.83 GPR119 (0.38) GPR119CYP1A2MEN1LMNAKMT2A
SCHEMBL8906956 0.81 ALDH1A1 (0.44) PPARGDHODHMEN1LMNAKMT2A
SCHEMBL8905734 0.80 GPR119 (0.42) GPR119MEN1KMT2A
SCHEMBL8905936 0.76 GPR119 (0.35) GPR119
SCHEMBL8905700 0.76 PPARG (0.50) PPARG
SCHEMBL8906316 0.75 PPARG (0.44) PPARGDHODH
SCHEMBL9094676 0.75 PPARG (0.62) PPARG
SCHEMBL8906593 0.74 GPR119 (0.41) GPR119PPARGMEN1KMT2A

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
US-5684029-A HYPOTENSIVE AGENTS KARL THOMAE GMBH (DE) 1997-11-04 US disclosed