SCHEMBL10180472

SCHEMBL10180472

CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)NCCc1ccccc1

nearest known ligand 0.93

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 5/20 0.93
CNR1 P21554 5/20 0.74
CNR2 P34972 2/20 0.72
FAAH O00519 3/20 0.71
ALOX12 P18054 2/20 0.71
MEN1 O00255 2/20 0.71
MAPT P10636 2/20 0.71
KMT2A Q03164 2/20 0.71
ALDH1A1 P00352 1/20 0.71
HPGD P15428 1/20 0.71
TRPV1 Q8NER1 1/20 0.71
TRPM8 Q7Z2W7 1/20 0.71
SLC6A5 Q9Y345 1/20 0.66

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
SCHEMBL10180474 1.00 EPHX2 (0.93) EPHX2CNR1CNR2FAAHALOX12
SCHEMBL28665630 0.96 EPHX2 (1.00) EPHX2CNR1CNR2FAAHALOX12
SCHEMBL22411430 0.94 EPHX2 (0.95) EPHX2CNR1CNR2FAAHALOX12
SCHEMBL6511518 0.89 CNR1 (0.77) EPHX2CNR1CNR2FAAHALOX12
SCHEMBL6511512 0.89 CNR1 (0.77) EPHX2CNR1CNR2FAAHALOX12
SCHEMBL18248591 0.87 EPHX2 (1.00) EPHX2CNR1CNR2FAAHMEN1
SCHEMBL7426779 0.86 EPHX2 (0.78) EPHX2HPGDTRPV1
SCHEMBL10066131 0.86 EPHX2 (0.82) EPHX2CNR1CNR2FAAHMAPT
SCHEMBL1456740 0.85 EPHX2 (0.80) EPHX2MEN1MAPTKMT2AHPGD
SCHEMBL19043177 0.85 EPHX2 (0.80) EPHX2MEN1MAPTKMT2AHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1636335-B1 COMPOSITIONS AND METHODS FOR INHIBITING AN ISOFORM OF HUMAN MANGANESE SUPEROXIDE DISMUTASE MITO TEK LLC (US) 2012-07-11 EP claimed