SCHEMBL9737230

SCHEMBL9737230

CCCC(=O)c1nc(CC)n(Cc2ccc(-c3ccccc3)c(C(=O)O)c2)n1

nearest known ligand 0.48

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 1/20 0.44
AGTR1 P30556 10/20 0.44
AGTR2 P50052 10/20 0.44

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
SCHEMBL9530302 0.94 AGTR1 (0.47) FOLH1AGTR1AGTR2
SCHEMBL6007873 0.89 AGTR1 (0.56) AGTR1AGTR2
SCHEMBL9529085 0.87 FOLH1 (0.45) FOLH1AGTR1AGTR2
SCHEMBL9553474 0.86 FOLH1 (0.44) FOLH1AGTR1AGTR2
SCHEMBL9735863 0.84 FOLH1 (0.39) FOLH1AGTR1AGTR2
SCHEMBL9528852 0.84 FOLH1 (0.41) FOLH1AGTR1AGTR2
SCHEMBL9528847 0.84 FOLH1 (0.41) FOLH1AGTR1AGTR2
SCHEMBL6005831 0.83 AGTR1 (0.59) AGTR1AGTR2
SCHEMBL9738591 0.82 AGTR1 (0.54) AGTR1AGTR2
SCHEMBL9552165 0.82 AGTR1 (0.43) FOLH1AGTR1AGTR2

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-1992004335-A2 RENAL-SELECTIVE BIPHENYLALKYL 1H-SUBSTITUTED-1,2,4-TRIAZOLE ANGIOTENSIN II ANTAGONISTS FOR TREATMENT OF HYPERTENSION G.D. SEARLE & CO. (US) 1992-03-19 WO disclosed