SCHEMBL9738591

SCHEMBL9738591

CCCCc1nc(C(=O)Cc2ccccc2)nn1Cc1ccc(-c2ccccc2)c(C(=O)O)c1

nearest known ligand 0.59

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 13/20 0.54
AGTR2 P50052 13/20 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
SCHEMBL6005985 0.90 AGTR1 (0.68) AGTR1AGTR2
SCHEMBL6008219 0.87 AGTR1 (0.68) AGTR1AGTR2
SCHEMBL9532478 0.86 AGTR1 (0.54) AGTR1AGTR2
SCHEMBL8841285 0.85 AGTR1 (0.56) AGTR1AGTR2
SCHEMBL8105315 0.85 AGTR1 (0.59) AGTR1AGTR2
SCHEMBL9530302 0.85 AGTR1 (0.47) AGTR1AGTR2
SCHEMBL8841327 0.84 AGTR1 (0.56) AGTR1AGTR2
SCHEMBL6005830 0.83 AGTR1 (0.59) AGTR1AGTR2
SCHEMBL8841462 0.83 AGTR1 (0.54) AGTR1AGTR2
SCHEMBL9737230 0.82 FOLH1 (0.44) 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
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 claimed
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