SCHEMBL9707742

SCHEMBL9707742

CCCCc1nc2c(c(=O)[nH]c(=O)n2-c2ccccc2)n1Cc1ccc(-c2ccccc2-c2nnn[nH]2)cc1

nearest known ligand 0.49

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
AGTR2 P50052 11/20 0.49
AGTR1 P30556 10/20 0.49

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
SCHEMBL9708479 0.98 AGTR2 (0.46) AGTR2AGTR1
SCHEMBL9707926 0.95 AGTR2 (0.46) AGTR2AGTR1
SCHEMBL9708587 0.92 AGTR1 (0.45) AGTR2AGTR1
SCHEMBL9707992 0.90 USP2 (0.51) AGTR2AGTR1
SCHEMBL9708426 0.90 MEN1 (0.53) AGTR2AGTR1
SCHEMBL9708270 0.89 MEN1 (0.49) AGTR2AGTR1
SCHEMBL9707286 0.89 AGTR1 (0.50) AGTR2AGTR1
SCHEMBL9708221 0.88 MEN1 (0.41) AGTR2AGTR1
SCHEMBL9708236 0.88 AGTR1 (0.50) AGTR2AGTR1
SCHEMBL9707621 0.87 AGTR1 (0.49) AGTR2AGTR1

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-1992007852-A1 BIPHENYLALKYL XANTHINE COMPOUNDS FOR TREATMENT OF CARDIOVASCULAR DISORDERS G.D. SEARLE & CO. (US) 1992-05-14 WO disclosed