SCHEMBL9850832

SCHEMBL9850832

CCCCCC(C)OCCCC(F)(F)F

nearest known ligand 0.38

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
FAAH O00519 5/20 0.35
OPRM1 P35372 1/20 0.34
DNM1 Q05193 1/20 0.32
CNR1 P21554 1/20 0.32
CNR2 P34972 1/20 0.32
EPHX2 P34913 1/20 0.32
MLYCD O95822 1/20 0.31
CES2 O00748 1/20 0.30
CES1 P23141 1/20 0.30

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
SCHEMBL9850833 0.98 FAAH (0.37) FAAHOPRM1DNM1CNR1CNR2
SCHEMBL9850607 0.95 DNM1 (0.35) FAAHOPRM1DNM1CNR1CNR2
SCHEMBL9850845 0.94 EPHX2 (0.35) EPHX2
SCHEMBL9850811 0.91 FAAH (0.36) FAAHOPRM1CNR1CNR2CES2
SCHEMBL9850732 0.89 EPHX2 (0.36) DNM1EPHX2CES2CES1
SCHEMBL9850858 0.89 FAAH (0.38) FAAHOPRM1DNM1CNR1CNR2
SCHEMBL9850853 0.89
SCHEMBL17743232 0.89
SCHEMBL9850737 0.85 EPHX2 (0.33) FAAHEPHX2
SCHEMBL9850764 0.83 EPHX2 (0.30) EPHX2

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