SCHEMBL8801692

SCHEMBL8801692

CCCCc1c(Cc2ccc(-c3ccccc3-c3nnn[nH]3)cc2)c(=O)nc2n1CC(C)(C)C(=O)N2

nearest known ligand 0.39

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SLC33A1 O00400 6/20 0.38
AGTR1 P30556 1/20 0.37
LTB4R2 Q9NPC1 1/20 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
SCHEMBL8672202 0.89 SLC33A1 (0.38) SLC33A1
SCHEMBL8801621 0.87 AGTR1 (0.39) AGTR1LTB4R2
SCHEMBL8801815 0.86 SLC33A1 (0.37) SLC33A1AGTR1
SCHEMBL8802003 0.86 SLC33A1 (0.37) SLC33A1AGTR1LTB4R2
SCHEMBL8801137 0.82 SLC33A1 (0.38) SLC33A1
SCHEMBL8801639 0.82 SLC33A1 (0.39) SLC33A1
SCHEMBL8802014 0.82 AGTR1 (0.46) SLC33A1AGTR1
SCHEMBL8801884 0.81 SLC33A1 (0.40) SLC33A1
SCHEMBL8801841 0.80 SLC33A1 (0.37) SLC33A1AGTR1LTB4R2
SCHEMBL9269707 0.80 PSMB5 (0.32) 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0680480-B1 PYRIMIDINONE DERIVATIVES FUSED TO NITROGEN HETEROCYCLES HAVING A II ANTAGONISTIC ACTIVITY LUSO FARMACO INST (IT) 1997-07-30 EP claimed
WO-1994017067-A1 PYRIMIDINONE DERIVATIVES FUSED TO NITROGEN HETEROCYCLES HAVING A II ANTAGONISTIC ACTIVITY ISTITUTO LUSO FARMACO D'ITALIA S.P.A. (IT) 1994-08-04 WO claimed
EP-0680480-B1 PYRIMIDINONE DERIVATIVES FUSED TO NITROGEN HETEROCYCLES HAVING A II ANTAGONISTIC ACTIVITY LUSO FARMACO INST (IT) 1997-07-30 EP disclosed
WO-1994017067-A1 PYRIMIDINONE DERIVATIVES FUSED TO NITROGEN HETEROCYCLES HAVING A II ANTAGONISTIC ACTIVITY ISTITUTO LUSO FARMACO D'ITALIA S.P.A. (IT) 1994-08-04 WO disclosed