SCHEMBL9558461

SCHEMBL9558461

CCCCc1nc2c(n1Cc1ccc(-c3ccccc3-c3nnn[nH]3)cc1)C(C(C)=O)N(C(=O)OCC)CC2

nearest known ligand 0.47

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 7/20 0.47
AGTR2 P50052 7/20 0.47
PPARG P37231 1/20 0.43

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
SCHEMBL9144625 0.88 AGTR1 (0.47) AGTR1AGTR2
SCHEMBL9141104 0.87 AGTR1 (0.44) AGTR1AGTR2PPARG
SCHEMBL9141881 0.87 AGTR1 (0.46) AGTR1AGTR2
SCHEMBL9141887 0.87 AGTR1 (0.45) AGTR1AGTR2
SCHEMBL9044951 0.87 AGTR1 (0.45) AGTR1AGTR2PPARG
SCHEMBL9044302 0.86 AGTR1 (0.44) AGTR1AGTR2PPARG
SCHEMBL9142834 0.86 AGTR1 (0.43) AGTR1AGTR2
SCHEMBL9142252 0.85 AGTR1 (0.46) AGTR1AGTR2
SCHEMBL9043684 0.85 AGTR1 (0.43) AGTR1AGTR2PPARG
SCHEMBL9044294 0.84 AGTR1 (0.41) AGTR1AGTR2

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-5279362-A None JP disclosed
JP-H05279362-A IMIDAZOPYRIDINE DERIVATIVE AND ITS PRODUCTION TANABE SEIYAKU CO LTD 1993-10-26 JP disclosed