SCHEMBL9422973

SCHEMBL9422973

CCCCc1nc2cc(Cl)cc(C(=O)O)c2n1-c1ccc(C(=O)O)cc1

nearest known ligand 0.51

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 6/20 0.51
AGTR2 P50052 6/20 0.51
LMNA P02545 1/20 0.45
MAPK1 P28482 1/20 0.45
ESR1 P03372 1/20 0.43
ESR2 Q92731 1/20 0.43
MEN1 O00255 1/20 0.42
POLB P06746 1/20 0.42
PABPC1 P11940 1/20 0.42
KMT2A Q03164 1/20 0.42
TLR7 Q9NYK1 1/20 0.42

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 0.85 AGTR2 (0.66) AGTR1AGTR2TLR7
SCHEMBL9422812 0.83 AGTR1 (0.58) AGTR1AGTR2TLR7
SCHEMBL9422810 0.82 AGTR1 (0.47) AGTR1AGTR2TLR7
SCHEMBL9422906 0.76 AGTR1 (0.49) AGTR1AGTR2
SCHEMBL9754985 0.75 AGTR2 (0.54) AGTR1AGTR2
SCHEMBL9422984 0.74 KDM4E (0.53) AGTR1AGTR2LMNA
SCHEMBL9422766 0.74 AGTR2 (0.55) AGTR1AGTR2
SCHEMBL4959079 0.74 MAPK1 (0.80) AGTR1AGTR2LMNAMAPK1MEN1
SCHEMBL9422752 0.73 AGTR1 (0.61) AGTR1AGTR2TLR7
SCHEMBL8436528 0.72 AGTR1 (0.45) AGTR1AGTR2LMNAMAPK1ESR1

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