SCHEMBL9531316

SCHEMBL9531316

CCCCc1c(O)c2ccc(OC)cc2n(Cc2ccc(-c3ccccc3C(=O)O)cc2)c1=O

nearest known ligand 0.75

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 3/20 0.54
AGTR2 P50052 3/20 0.54
PPARG P37231 4/20 0.53

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
SCHEMBL9535760 0.92 AGTR1 (0.47) AGTR1AGTR2PPARG
SCHEMBL9531841 0.86 PPARG (0.52) PPARG
SCHEMBL9531904 0.84 PPARG (0.50) PPARG
SCHEMBL9534507 0.80 PPARG (0.53) PPARG
SCHEMBL9531469 0.79 PPARG (0.49) AGTR1AGTR2PPARG
SCHEMBL9536684 0.79 MAPK8 (0.55) PPARG
SCHEMBL8393674 0.78 PPARG (0.81) AGTR1AGTR2PPARG
SCHEMBL9532603 0.77 AGTR1 (0.66) AGTR1AGTR2PPARG
SCHEMBL8395217 0.77 PPARG (0.81) AGTR1AGTR2PPARG
SCHEMBL9530978 0.76 PPARG (0.51) AGTR1AGTR2PPARG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0572455-A1 SUBSTITUTED PYRIDINONES AND PYRIMIDINONES AS ANGIOTENSIN II ANTAGONISTS Astra Pharmaceuticals Limited (GB) 1993-12-08 EP claimed
WO-1992014714-A1 SUBSTITUTED PYRIDINONES AND PYRIMIDINONES AS ANGIOTENSIN II ANTAGONISTS FISONS PLC (GB) 1992-09-03 WO claimed
EP-0500297-A1 Substituted pyridinones and pyrimidinones as angiotensin II antagonists FISONS plc (GB) 1992-08-26 EP claimed
EP-0572455-A1 SUBSTITUTED PYRIDINONES AND PYRIMIDINONES AS ANGIOTENSIN II ANTAGONISTS Astra Pharmaceuticals Limited (GB) 1993-12-08 EP disclosed
WO-1992014714-A1 SUBSTITUTED PYRIDINONES AND PYRIMIDINONES AS ANGIOTENSIN II ANTAGONISTS FISONS PLC (GB) 1992-09-03 WO disclosed
EP-0500297-A1 Substituted pyridinones and pyrimidinones as angiotensin II antagonists FISONS plc (GB) 1992-08-26 EP disclosed