SCHEMBL809745

SCHEMBL809745

C=Cc1ccc(CCl)cc1OC(C)=O

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 1/20 0.51
CYP4F2 P78329 1/20 0.45
CYP4A11 Q02928 1/20 0.45
ALOX5 P09917 2/20 0.42
CFD P00746 1/20 0.42
AKT1 P31749 1/20 0.42
LMNA P02545 4/20 0.38
RAB9A P51151 3/20 0.38
NPC1 O15118 2/20 0.38
HTT P42858 2/20 0.38
PKM P14618 1/20 0.38
MAPT P10636 3/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
ALOX12 P18054 1/20 0.38
NCOA1 Q15788 1/20 0.38
NCOA3 Q9Y6Q9 1/20 0.38
GSTP1 P09211 1/20 0.37
KDM4E B2RXH2 3/20 0.36
MEN1 O00255 3/20 0.36
KMT2A Q03164 3/20 0.36

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
SCHEMBL810068 0.89 PTGS1 (0.50) PTGS1CYP4F2CYP4A11ALOX5CFD
SCHEMBL809884 0.88 AKT1 (0.56) PTGS1CYP4F2CYP4A11ALOX5CFD
SCHEMBL809941 0.85 AKT1 (0.47) PTGS1CYP4F2CYP4A11ALOX5CFD
SCHEMBL810128 0.84 PTGS1 (0.51) PTGS1CYP4F2CYP4A11ALOX5CFD
SCHEMBL810049 0.84 PTGS1 (0.51) PTGS1CYP4F2CYP4A11ALOX5CFD
SCHEMBL3681025 0.82 KMT2A (0.47) PTGS1CYP4F2CYP4A11ALOX5CFD
SCHEMBL27439820 0.82 PTGS1 (0.49) PTGS1CYP4F2CYP4A11ALOX5CFD
SCHEMBL809961 0.82 PTGS1 (0.49) PTGS1CYP4F2CYP4A11ALOX5CFD
SCHEMBL11862228 0.82 PTGS1 (0.54) PTGS1CYP4F2CYP4A11CFDAKT1
SCHEMBL10795938 0.79 CFD (0.49) PTGS1CYP4F2CYP4A11CFDAKT1

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
WO-2012015977-A3 HIGHLY PORTABLE AND STABLE WORK STATION HERSCHLER MATTHEW B (US) 2012-05-10 WO disclosed
EP-2192645-B1 SEPARATION MEMBRANE FOR DIRECT LIQUID FUEL CELL AND METHOD FOR PRODUCING THE SAME TOKUYAMA CORP (JP) 2011-11-30 EP disclosed
US-20110250525-A1 SEPARATION MEMBRANE FOR DIRECT LIQUID FUEL CELL AND METHOD FOR PRODUCING THE SAME TOKUYAMA CORPORATION (JP) 2011-10-13 US disclosed
EP-2192645-A1 SEPARATION MEMBRANE FOR DIRECT LIQUID FUEL CELL AND METHOD FOR PRODUCING THE SAME Tokuyama Corporation (JP) 2010-06-02 EP disclosed