SCHEMBL9422855

SCHEMBL9422855

CCCCc1nc2c(C)c(Cl)cc(C(=O)O)c2n1Cc1ccc(C(=O)O)cc1

nearest known ligand 0.60

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 7/20 0.60
AGTR2 P50052 7/20 0.60
TLR7 Q9NYK1 3/20 0.57
TLR8 Q9NR97 1/20 0.49

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
SCHEMBL7055933 0.81 AGTR2 (0.66) AGTR1AGTR2TLR7
SCHEMBL9422752 0.80 AGTR1 (0.61) AGTR1AGTR2TLR7
SCHEMBL9422897 0.77 AGTR1 (0.86) AGTR1AGTR2
SCHEMBL9537616 0.77 NOTUM (0.46) AGTR1AGTR2
SCHEMBL9125473 0.77 AGTR1 (0.71) AGTR1AGTR2TLR7
SCHEMBL9422790 0.76 KDM4E (0.48)
SCHEMBL9200811 0.75 AGTR1 (1.00) AGTR1AGTR2TLR7
SCHEMBL9422766 0.73 AGTR2 (0.55) AGTR1AGTR2
SCHEMBL9422812 0.73 AGTR1 (0.58) AGTR1AGTR2TLR7
SCHEMBL9125532 0.73 AGTR1 (0.80) AGTR1AGTR2TLR7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5294631-A Substituted benzimidazoles useful as angiotension II receptor antagonists SMITHKLINE BEECHAM CORPORATION (US) 1994-03-15 US claimed
EP-0525129-A4 SUBSTITUTED BENZIMIDAZOLES 1993-03-24 EP claimed
EP-0525129-A1 SUBSTITUTED BENZIMIDAZOLES SMITHKLINE BEECHAM CORPORATION (US) 1993-02-03 EP claimed
WO-1991016313-A1 SUBSTITUTED BENZIMIDAZOLES SMITHKLINE BEECHAM CORPORATION (US) 1991-10-31 WO claimed
US-5294631-A Substituted benzimidazoles useful as angiotension II receptor antagonists SMITHKLINE BEECHAM CORPORATION (US) 1994-03-15 US disclosed
EP-0525129-A4 SUBSTITUTED BENZIMIDAZOLES 1993-03-24 EP disclosed
EP-0525129-A1 SUBSTITUTED BENZIMIDAZOLES SMITHKLINE BEECHAM CORPORATION (US) 1993-02-03 EP disclosed
WO-1991016313-A1 SUBSTITUTED BENZIMIDAZOLES SMITHKLINE BEECHAM CORPORATION (US) 1991-10-31 WO disclosed