SCHEMBL9212989

SCHEMBL9212989

CCCCc1ncc(CCN[C@@](C)(Cc2cccs2)C(=O)O)n1Cc1ccccc1Cl

nearest known ligand 0.59

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 1/20 0.57

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
SCHEMBL9207107 0.93 AGTR1 (0.58) AGTR1
SCHEMBL9205297 0.88
SCHEMBL9868324 0.86 AGTR1 (0.63) AGTR1
SCHEMBL9205161 0.85 AGTR1 (0.54) AGTR1
SCHEMBL9208575 0.83 AGTR1 (0.58) AGTR1
SCHEMBL9210887 0.81
SCHEMBL9210894 0.81
SCHEMBL7269794 0.80 AGTR1 (0.58) AGTR1
SCHEMBL9206295 0.80
SCHEMBL9206292 0.80

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
EP-0427463-B1 Substituted N-(imidazolyl)alkyl alanine derivatives SMITHKLINE BEECHAM CORP (US) 1995-03-08 EP disclosed
US-5248689-A Hypotensive agents, congestive heart failure, renal failure or glaucoma SMITHKLINE BEECHAM CORPORATION (US) 1993-09-28 US disclosed
EP-0427463-A1 Substituted N-(imidazolyl)alkyl alanine derivatives SMITHKLINE BEECHAM CORPORATION (US) 1991-05-15 EP disclosed