SCHEMBL9533015

SCHEMBL9533015

CCCCc1cc(O)c([N+](=O)[O-])c(=O)n1Cc1ccc(-c2ccccc2-c2nnn[nH]2)cc1

nearest known ligand 0.49

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 1/20 0.42
AGTR2 P50052 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
SCHEMBL9531301 0.86 AGTR1 (0.45) AGTR1AGTR2
SCHEMBL9533532 0.82 AGTR1 (0.47) AGTR1AGTR2
SCHEMBL9340932 0.81
SCHEMBL9530769 0.81 AGTR1 (0.62) AGTR1AGTR2
SCHEMBL9262756 0.81 AGTR1 (0.48) AGTR1AGTR2
SCHEMBL9690193 0.80 PPARG (0.52) AGTR1AGTR2
SCHEMBL8885855 0.80 AGTR1 (0.51) AGTR1AGTR2
SCHEMBL9402081 0.78 AGTR1 (0.48) AGTR1AGTR2
SCHEMBL9260166 0.78 AGTR1 (0.45) AGTR1AGTR2
SCHEMBL8887101 0.78 AGTR1 (0.51) AGTR1AGTR2

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-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