SCHEMBL9533159

SCHEMBL9533159

CSc1ccc2c(O)c(-c3ccccc3)c(=O)n(Cc3ccc(-c4ccccc4-c4nnn[nH]4)cc3)c2c1

nearest known ligand 0.73

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.39
RCE1 Q9Y256 1/20 0.39
MEN1 O00255 1/20 0.38
ALDH1A1 P00352 1/20 0.38
POLB P06746 1/20 0.38
RECQL P46063 1/20 0.38
CASP6 P55212 1/20 0.38
KMT2A Q03164 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
GAA P10253 1/20 0.37
SRC P12931 2/20 0.37

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
SCHEMBL9531601 0.87 MAPK8 (0.43)
SCHEMBL9531373 0.87 EGLN1 (0.41) SRC
SCHEMBL9532793 0.86 KDM4E (0.39) KDM4ERCE1
SCHEMBL7435772 0.83 BCL2 (0.41)
SCHEMBL9690851 0.80 PPARG (0.44) KDM4ERCE1GAA
Bromide SCHEMBL9350589 0.75 CYP3A4 (0.41)
SCHEMBL9530986 0.73 AGTR1 (0.40) KDM4EALDH1A1RECQLL3MBTL1
Hydrochloric Acid SCHEMBL7284739 0.72 AGTR1 (0.41)
SCHEMBL7322677 0.72 MAPT (0.39) MEN1ALDH1A1RECQLKMT2A
SCHEMBL9262511 0.72 ALDH1A1 (0.39) ALDH1A1RECQL

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 disclosed