SCHEMBL9873568

SCHEMBL9873568

CCCCc1nc2c(n1Cc1ccc(-c3ccccc3-c3nnn[nH]3)cc1)C(=S)N=NC2=S

nearest known ligand 0.49

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 7/20 0.49
AGTR2 P50052 7/20 0.49
GP6 Q9HCN6 1/20 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
SCHEMBL9873969 0.86 AGTR2 (0.35) AGTR1AGTR2
SCHEMBL9873248 0.85 AGTR1 (0.42) AGTR1AGTR2
SCHEMBL940 0.84 GP6 (0.56) AGTR1AGTR2GP6
SCHEMBL9007471 0.83 AGTR1 (0.50) AGTR1AGTR2
SCHEMBL9874581 0.83 AGTR1 (0.33) AGTR1AGTR2
SCHEMBL9007486 0.82 AGTR1 (0.49) AGTR1AGTR2
SCHEMBL8393351 0.82 AGTR1 (0.70) AGTR1AGTR2
SCHEMBL9007495 0.82 AGTR1 (0.49) AGTR1AGTR2
SCHEMBL13036727 0.81 AGTR1 (0.51) AGTR1AGTR2
SCHEMBL9007491 0.81 AGTR1 (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-1991019715-A1 1H-SUBSTITUTED-IMIDAZO[4,5-d]PYRIDAZINE COMPOUNDS FOR TREATMENT OF CARDIOVASCULAR DISORDERS G.D. SEARLE & CO. (US) 1991-12-26 WO disclosed