SCHEMBL7306983

SCHEMBL7306983

CCCc1nc(C(=O)OCc2ccc(-c3ccccc3-c3nnnn3C(c3ccccc3)(c3ccccc3)c3ccccc3)cc2)c(C(C)O)n1COC(=O)C(C)(C)C

nearest known ligand 0.49

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 8/20 0.49
AGTR2 P50052 8/20 0.49
AGT P01019 2/20 0.43
ABCC3 O15438 1/20 0.36
ABCC4 O15439 1/20 0.36
ABCB11 O95342 1/20 0.36
CYP3A4 P08684 1/20 0.36
PDE4D Q08499 1/20 0.36
PDE3A Q14432 1/20 0.36
SLCO1B3 Q9NPD5 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
SLCO1B1 Q9Y6L6 1/20 0.36

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
SCHEMBL7306141 0.92 AGTR1 (0.52) AGTR1AGTR2AGT
SCHEMBL7908422 0.90 AGTR1 (0.51) AGTR1AGTR2AGT
SCHEMBL7297179 0.90 AGTR1 (0.51) AGTR1AGTR2AGTABCC3ABCC4
SCHEMBL8860950 0.90 AGTR1 (0.51) AGTR1AGTR2AGTABCC3ABCC4
SCHEMBL7305959 0.87 AGT (0.52) AGTR1AGTR2AGT
SCHEMBL7887865 0.87 AGTR1 (0.41) AGTR1AGTR2AGTABCC3ABCC4
SCHEMBL7302840 0.84 AGTR1 (0.43) AGTR1AGTR2AGTABCC3ABCC4
SCHEMBL668341 0.83 AGTR1 (0.44) AGTR1AGTR2ABCC3ABCC4ABCB11
SCHEMBL7311058 0.83 AGTR1 (0.48) AGTR1AGTR2AGTABCC3ABCC4
SCHEMBL1988059 0.83 AGTR1 (0.54) AGTR1AGTR2AGTABCC3ABCC4

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0545912-B1 1-Biphenylmethylimidazole derivatives, their preparation and their therapeutic use SANKYO CO (JP) 2001-04-25 EP disclosed
US-5646171-A HYPOTENSIVE AGENTS SANKYO COMPANY, LIMITED (JP) 1997-07-08 US disclosed
US-5616599-A HYPOTENSIVE AGENTS FOR CARDIOVASCULAR DISORDER SANKYO COMPANY, LIMITED (JP) 1997-04-01 US disclosed
EP-0545912-A2 1-Biphenylmethylimidazole derivatives, their preparation and their therapeutic use Sankyo Company Limited (JP) 1993-06-09 EP disclosed
EP-0503785-A1 1-Biphenylimidazole derivatives, their preparation and their therapeutic use Sankyo Company Limited (JP) 1992-09-16 EP disclosed