SCHEMBL9535254

SCHEMBL9535254

NCc1ccc2oc(-c3ccccc3-c3nnn(C(c4ccccc4)(c4ccccc4)c4ccccc4)n3)c(Br)c2c1

nearest known ligand 0.40

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 2/20 0.38

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
SCHEMBL8545582 0.92 AGTR1 (0.39) AGTR1
SCHEMBL27367557 0.89 AGTR1 (0.39) AGTR1
SCHEMBL8544342 0.85 AGTR1 (0.35) AGTR1
SCHEMBL27369310 0.80 AGTR1 (0.58) AGTR1
SCHEMBL8545586 0.80 AGTR1 (0.38) AGTR1
SCHEMBL9310941 0.80 AGTR1 (0.51) AGTR1
SCHEMBL9311227 0.80 AGTR1 (0.35) AGTR1
SCHEMBL9481748 0.79 AGTR1 (0.45) AGTR1
SCHEMBL9859304 0.79 AGTR1 (0.47) AGTR1
SCHEMBL8544153 0.79 AGTR1 (0.42) AGTR1

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 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