SCHEMBL18157870

SCHEMBL18157870

CCCCCCCC/C=C/CCCCCCCC(=O)NCCN(CCNC(=O)CCCCCCC/C=C/CCCCCCCC)CCNC(=O)CCCCCCC/C=C/CCCCCCCC

nearest known ligand 0.72

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 2/20 0.68
CNR1 P21554 5/20 0.67
ALDH1A1 P00352 2/20 0.67
HPGD P15428 2/20 0.67
SLC6A5 Q9Y345 2/20 0.67
TRPV1 Q8NER1 1/20 0.67
MEN1 O00255 1/20 0.67
MAPT P10636 1/20 0.67
ALOX12 P18054 1/20 0.67
BLM P54132 1/20 0.67
KMT2A Q03164 1/20 0.67
TDP1 Q9NUW8 1/20 0.67
DNM1 Q05193 1/20 0.64
KDM4E B2RXH2 1/20 0.63
LPAR1 Q92633 1/20 0.63
FAAH O00519 1/20 0.62
CNR2 P34972 1/20 0.62

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
SCHEMBL5529570 1.00 EPHX2 (0.68) EPHX2CNR1ALDH1A1HPGDSLC6A5
SCHEMBL5529572 1.00 EPHX2 (0.68) EPHX2CNR1ALDH1A1HPGDSLC6A5
SCHEMBL13114479 0.97 EPHX2 (0.65) EPHX2CNR1ALDH1A1HPGDSLC6A5
SCHEMBL18157804 0.96 CNR1 (0.74) CNR1ALDH1A1HPGDTRPV1MEN1
SCHEMBL13186305 0.94 LPAR1 (0.65) EPHX2CNR1ALDH1A1HPGDSLC6A5
SCHEMBL3969115 0.94 EPHX2 (0.65) EPHX2CNR1ALDH1A1HPGDSLC6A5
SCHEMBL15483377 0.94 EPHX2 (0.65) EPHX2CNR1ALDH1A1HPGDSLC6A5
SCHEMBL2410108 0.94 EPHX2 (0.65) EPHX2CNR1ALDH1A1HPGDSLC6A5
SCHEMBL3505712 0.93 SLC6A5 (0.71) EPHX2CNR1ALDH1A1HPGDSLC6A5
SCHEMBL540111 0.93 SLC6A5 (0.71) EPHX2CNR1ALDH1A1HPGDSLC6A5

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
WO-2016168469-A1 FATTY ACID ANALOGS AND METHODS OF USE THEREOF THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2016-10-20 WO disclosed