SCHEMBL9552425

SCHEMBL9552425

CCCc1nc(Cc2ccc(-c3ccccc3-c3nnn[nH]3)cc2)n(CC)n1

nearest known ligand 0.53

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 3/20 0.53
AGTR2 P50052 2/20 0.46

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
SCHEMBL9552184 0.94 AGTR1 (0.61) AGTR1AGTR2
SCHEMBL9553107 0.93 AGTR1 (0.58) AGTR1AGTR2
SCHEMBL9552841 0.93 AGTR1 (0.57) AGTR1AGTR2
SCHEMBL9552156 0.92 AGTR1 (0.49) AGTR1AGTR2
SCHEMBL9552447 0.92 AGTR1 (0.49) AGTR1AGTR2
SCHEMBL9552098 0.92 AGTR1 (0.48) AGTR1AGTR2
SCHEMBL9553444 0.91 AGTR1 (0.65) AGTR1AGTR2
SCHEMBL9552366 0.91 AGTR1 (0.47) AGTR1AGTR2
SCHEMBL9552724 0.91 AGTR1 (0.49) AGTR1AGTR2
SCHEMBL9552728 0.91 AGTR1 (0.49) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5229406-A Treatment of glaucoma G. D. SEARLE & CO. (US) 1993-07-20 US disclosed
US-5140036-A Hypotensive agents; congestive heart failure; angiotensin antagonists G. D. SEARLE & CO. (US) 1992-08-18 US disclosed
WO-1992005161-A1 1,3,5-TRISUBSTITUTED-1,2,4-TRIAZOLE COMPOUNDS FOR TREATMENT OF CIRCULATORY DISORDERS G.D. SEARLE & CO. (US) 1992-04-02 WO disclosed