SCHEMBL9708101

SCHEMBL9708101

CCCCc1nc2[nH]c(=O)[nH]c(=O)c2n1Cc1ccc(-c2ccccc2-c2nnn[nH]2)cc1

nearest known ligand 0.54

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 11/20 0.54
AGTR2 P50052 11/20 0.54

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
SCHEMBL9707513 0.97 AGTR1 (0.51) AGTR1AGTR2
SCHEMBL9708752 0.95 AGTR1 (0.51) AGTR1AGTR2
SCHEMBL9707628 0.91 AGTR1 (0.50) AGTR1AGTR2
SCHEMBL9708173 0.87 AGTR1 (0.41) AGTR1AGTR2
SCHEMBL9707616 0.86 AGTR1 (0.51) AGTR1AGTR2
SCHEMBL9708406 0.86 AGTR1 (0.50) AGTR1AGTR2
SCHEMBL9707756 0.86 AGTR1 (0.50) AGTR1AGTR2
SCHEMBL9707720 0.86 AGTR1 (0.43) AGTR1AGTR2
SCHEMBL9708086 0.85 AGTR1 (0.49) AGTR1AGTR2
SCHEMBL9707992 0.85 USP2 (0.51) 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 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