SCHEMBL9532111

SCHEMBL9532111

CCCc1cc(O)cc(=O)n1Cc1ccc(OC(C(=O)O)c2ccccc2)cc1

nearest known ligand 0.54

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ AGTR2 P50052 1/20 0.42
▸ PPARG P37231 5/20 0.42
▸ PPARA Q07869 5/20 0.42
▸ EDNRB P24530 1/20 0.42
▸ EDNRA P25101 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
SCHEMBL9533888 0.94 PTPN1 (0.45) AGTR2EDNRBEDNRA
SCHEMBL9591325 0.80 AGTR2 (0.53) AGTR2EDNRBEDNRA
SCHEMBL9532231 0.80 — —
SCHEMBL9592563 0.77 EDNRB (0.49) AGTR2EDNRBEDNRA
SCHEMBL9591738 0.75 GSK3B (0.50) AGTR2
SCHEMBL9531226 0.74 AGTR1 (0.35) AGTR2
SCHEMBL9590892 0.73 NPC1 (0.53) AGTR2
SCHEMBL9591188 0.72 AGTR2 (0.47) AGTR2
SCHEMBL9591814 0.71 PDE4A (0.47) AGTR2
SCHEMBL9088928 0.71 PPARG (0.61) AGTR2PPARG

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
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