SCHEMBL9850811

SCHEMBL9850811

CCCCCC(C)OCCC(F)(F)F

nearest known ligand 0.36

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
FAAH O00519 5/20 0.36
OPRM1 P35372 1/20 0.35
CNR1 P21554 1/20 0.33
CNR2 P34972 1/20 0.33
CES2 O00748 1/20 0.31
CES1 P23141 1/20 0.31
SPHK1 Q9NYA1 1/20 0.31
CA1 P00915 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
SCHEMBL9850858 0.98 FAAH (0.38) FAAHOPRM1CNR1CNR2CES2
SCHEMBL9850737 0.94 EPHX2 (0.33) FAAH
SCHEMBL9850832 0.91 FAAH (0.35) FAAHOPRM1CNR1CNR2CES2
SCHEMBL9850833 0.89 FAAH (0.37) FAAHOPRM1CNR1CNR2CES2
SCHEMBL9850607 0.89 DNM1 (0.35) FAAHOPRM1CNR1CNR2CES2
SCHEMBL9850829 0.86
SCHEMBL9850845 0.85 EPHX2 (0.35)
SCHEMBL9850732 0.83 EPHX2 (0.36) CES2CES1
SCHEMBL11225085 0.79 OPRM1 (0.44) FAAHOPRM1CNR1CNR2SPHK1
SCHEMBL14380991 0.79 DNM1 (0.45) FAAHOPRM1CNR1CNR2SPHK1

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