SCHEMBL9308166

SCHEMBL9308166

CCCCc1nc2cccnc2n1Cc1ccc2[nH]c(-c3ccccc3C(=O)O)nc2c1

nearest known ligand 0.54

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 4/20 0.54
AGTR2 P50052 4/20 0.54
PPARG P37231 3/20 0.51
ENPP2 Q13822 1/20 0.50

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
SCHEMBL7851373 0.83 AGTR1 (0.75) AGTR1AGTR2PPARG
SCHEMBL9235936 0.83 AGTR1 (0.57) AGTR1AGTR2PPARG
SCHEMBL9096716 0.83 AGTR1 (0.56) AGTR1AGTR2PPARG
SCHEMBL9305780 0.82 AGTR1 (0.72) AGTR1AGTR2
SCHEMBL9571356 0.80 AGTR1 (0.56) AGTR1AGTR2PPARGENPP2
SCHEMBL8329226 0.79 AGTR1 (0.52) AGTR1AGTR2PPARGENPP2
SCHEMBL7850236 0.79 AGTR1 (0.74) AGTR1AGTR2ENPP2
SCHEMBL9853648 0.78 PPARG (0.74) AGTR1AGTR2PPARG
SCHEMBL7853694 0.76 AGTR1 (0.71) AGTR1AGTR2PPARGENPP2
SCHEMBL9403816 0.76 AGTR1 (0.52) AGTR1AGTR2PPARGENPP2

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
JP-6073051-A None JP disclosed
JP-H0673051-A BENZAZOLE DERIVATIVE ASAHI GLASS CO LTD 1994-03-15 JP disclosed