SCHEMBL9531997

SCHEMBL9531997

Cc1ccc2c(O)c(-c3ccccc3)c(=O)n(Cc3ccc(-c4ccccc4C#N)cc3)c2n1

nearest known ligand 0.66

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PPARG P37231 3/20 0.45
DPP4 P27487 1/20 0.43
BCL2 P10415 1/20 0.41
MCL1 Q07820 1/20 0.41
CNR1 P21554 1/20 0.41
PDE9A O76083 1/20 0.41
PDE1C Q14123 1/20 0.41
MYC P01106 1/20 0.40
WDR5 P61964 1/20 0.40

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
SCHEMBL9690851 0.81 PPARG (0.44) PPARGCNR1PDE9APDE1C
SCHEMBL14208362 0.81 PPARG (0.48) PPARGDPP4CNR1PDE9APDE1C
SCHEMBL9690284 0.79 MAPK8 (0.46) PPARG
SCHEMBL9690123 0.77 ALOX5AP (0.46) PPARGCNR1
SCHEMBL1890010 0.74 PPARG (0.48) PPARGDPP4CNR1PDE9APDE1C
SCHEMBL1888964 0.74 PPARG (0.64) PPARG
SCHEMBL8804016 0.74 PPARG (0.48) PPARGDPP4CNR1
SCHEMBL1887155 0.74 PPARG (0.48) PPARGDPP4CNR1PDE9APDE1C
SCHEMBL1890122 0.72 PPARG (0.61) PPARG
SCHEMBL4012027 0.72 PPARG (0.63) PPARG

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