SCHEMBL6214767

SCHEMBL6214767

O=C(O)C=CCc1ccc2ccccc2c1

nearest known ligand 0.56

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TBXA2R P21731 1/20 0.56
PTGER4 P35408 1/20 0.56
PTGFR P43088 1/20 0.56
PTGER3 P43115 1/20 0.56
PTGER2 P43116 1/20 0.56
PTGDR Q13258 1/20 0.56
CYP1A2 P05177 2/20 0.50
PDPK1 O15530 1/20 0.50
GPR52 Q9Y2T5 1/20 0.47
SOX18 P35713 1/20 0.46
CYP2A6 P11509 1/20 0.44
SLC13A5 Q86YT5 1/20 0.43
NR1H4 Q96RI1 1/20 0.43
FTO Q9C0B1 1/20 0.43

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
SCHEMBL6214765 1.00 TBXA2R (0.56) TBXA2RPTGER4PTGFRPTGER3PTGER2
SCHEMBL30513113 0.85 GPR52 (0.57) TBXA2RPTGER4PTGFRPTGER3PTGER2
SCHEMBL6790462 0.85 CYP1A2 (0.45) TBXA2RPTGER4PTGFRPTGER3PTGER2
SCHEMBL27426512 0.85 PTGER3 (0.41) TBXA2RPTGER4PTGFRPTGER3PTGER2
SCHEMBL27622370 0.82 PTGER3 (0.65) PTGER4PTGER3PTGER2PTGDRCYP1A2
SCHEMBL16289222 0.81 CYP1A2 (0.60) TBXA2RPTGER4PTGFRPTGER3PTGER2
SCHEMBL14349796 0.81 KMT2A (0.45) TBXA2RPTGER4PTGFRPTGER3PTGER2
SCHEMBL30345495 0.80 MAOB (0.44) PTGER4PTGER2
SCHEMBL1233515 0.79 MAOB (0.61) PTGER4PTGER3PTGER2GPR52
SCHEMBL2555173 0.79 MAOB (0.61) PTGER4PTGER3PTGER2GPR52

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1256583-B1 Pyrimidine-4-one derivatives, process for their preparation and pharmaceutical compositions containing them SERVIER LAB (FR) 2005-08-10 EP disclosed
EP-1256583-A1 Pyrimidine-4-one derivatives, process for their preparation and pharmaceutical compositions containing them Les Laboratoires Servier (FR) 2002-11-13 EP disclosed