SCHEMBL19935541

SCHEMBL19935541

CNCCCNC(=O)CCCCC=O

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LPAR1 Q92633 1/20 0.50
EPHX2 P34913 2/20 0.46
SLC6A5 Q9Y345 2/20 0.45
CNR1 P21554 7/20 0.45
KDM4E B2RXH2 1/20 0.43
FAAH O00519 3/20 0.42
ALDH1A1 P00352 2/20 0.42
HPGD P15428 2/20 0.42
CNR2 P34972 2/20 0.42
TRPV1 Q8NER1 1/20 0.42
MEN1 O00255 1/20 0.42
MAPT P10636 1/20 0.42
ALOX12 P18054 1/20 0.42
BLM P54132 1/20 0.42
KMT2A Q03164 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
TSHR P16473 1/20 0.42

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
SCHEMBL20202534 0.95 EPHX2 (0.53) LPAR1EPHX2SLC6A5CNR1KDM4E
SCHEMBL25030622 0.95 EPHX2 (0.53) LPAR1EPHX2SLC6A5CNR1KDM4E
SCHEMBL12295581 0.91 EPHX2 (0.49) LPAR1EPHX2SLC6A5CNR1KDM4E
SCHEMBL31720955 0.88 CNR1 (0.45) LPAR1EPHX2SLC6A5CNR1FAAH
SCHEMBL17776037 0.85 EPHX2 (0.56) LPAR1EPHX2SLC6A5CNR1KDM4E
SCHEMBL18973140 0.85 EPHX2 (0.51) LPAR1EPHX2SLC6A5CNR1KDM4E
SCHEMBL23735528 0.84 EPHX2 (0.53) LPAR1EPHX2SLC6A5CNR1KDM4E
SCHEMBL14035358 0.84 CNR1 (0.63) LPAR1EPHX2SLC6A5CNR1KDM4E
SCHEMBL15362884 0.83 ALDH1A1 (0.54) LPAR1EPHX2SLC6A5CNR1KDM4E
SCHEMBL25793510 0.83 CASP2 (0.55) LPAR1EPHX2SLC6A5FAAHALDH1A1

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-2018044350-A1 TARGETING LIGANDS ARROWHEAD PHARMACEUTICALS, INC (US) 2018-03-08 WO disclosed