SCHEMBL9850607

SCHEMBL9850607

CCCCCC(C)OCCCCC(F)(F)F

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 1/20 0.35
FAAH O00519 5/20 0.34
OPRM1 P35372 1/20 0.33
EPHX2 P34913 1/20 0.33
CES2 O00748 2/20 0.33
CES1 P23141 1/20 0.33
CNR1 P21554 1/20 0.31
CNR2 P34972 1/20 0.31
LPAR1 Q92633 1/20 0.31
LPAR3 Q9UBY5 1/20 0.31
MLYCD O95822 1/20 0.31
PLA2G2C Q5R387 1/20 0.31

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
SCHEMBL9850832 0.95 FAAH (0.35) DNM1FAAHOPRM1EPHX2CES2
SCHEMBL9850732 0.95 EPHX2 (0.36) DNM1EPHX2CES2CES1
SCHEMBL9850833 0.93 FAAH (0.37) DNM1FAAHOPRM1EPHX2CES2
SCHEMBL9850811 0.89 FAAH (0.36) FAAHOPRM1CES2CES1CNR1
SCHEMBL9850845 0.89 EPHX2 (0.35) EPHX2
SCHEMBL9850764 0.89 EPHX2 (0.30) EPHX2
SCHEMBL9850858 0.87 FAAH (0.38) DNM1FAAHOPRM1CES2CES1
SCHEMBL14380991 0.84 DNM1 (0.45) DNM1FAAHOPRM1EPHX2CNR1
SCHEMBL9850737 0.83 EPHX2 (0.33) FAAHEPHX2
SCHEMBL17743232 0.83

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-0409634-A2 Liquid crystal compounds and optically active compounds SANYO CHEMICAL INDUSTRIES LTD. (JP) 1991-01-23 EP disclosed