SCHEMBL810128

SCHEMBL810128

C=Cc1ccc(CI)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 2/20 0.42
LTA4H P09960 1/20 0.38
PTGS2 P35354 3/20 0.37
AKT1 P31749 1/20 0.36
KDM4E B2RXH2 2/20 0.36
ALDH1A1 P00352 1/20 0.36
GAA P10253 1/20 0.36
TSHR P16473 1/20 0.36
RAB9A P51151 1/20 0.36
LMNA P02545 1/20 0.35
MAPT P10636 1/20 0.35
ALOX12 P18054 1/20 0.35
NCOA1 Q15788 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
NCOA3 Q9Y6Q9 1/20 0.35
MEN1 O00255 1/20 0.35

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
SCHEMBL810049 0.84 PTGS1 (0.51) PTGS1CYP4F2CYP4A11ALOX5CFD
SCHEMBL809745 0.84 PTGS1 (0.51) PTGS1CYP4F2CYP4A11ALOX5CFD
SCHEMBL809961 0.82 PTGS1 (0.49) PTGS1CYP4F2CYP4A11ALOX5CFD
SCHEMBL809884 0.82 AKT1 (0.56) PTGS1CYP4F2CYP4A11ALOX5CFD
SCHEMBL27439820 0.82 PTGS1 (0.49) PTGS1CYP4F2CYP4A11ALOX5CFD
SCHEMBL20095342 0.80 PTGS1 (0.57) PTGS1CYP4F2CYP4A11ALOX5CFD
SCHEMBL809941 0.80 AKT1 (0.47) PTGS1CYP4F2CYP4A11ALOX5CFD
SCHEMBL3681025 0.79 KMT2A (0.47) PTGS1CYP4F2CYP4A11ALOX5CFD
SCHEMBL30785274 0.79 KDM4E (0.56) PTGS1ALOX5KDM4EALDH1A1RAB9A
SCHEMBL3627110 0.79 KDM4E (0.56) PTGS1ALOX5KDM4EALDH1A1RAB9A

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