SCHEMBL14217642

SCHEMBL14217642

CCCCCCCCCCCCCCCCC(C)OCCOC

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
FAAH O00519 5/20 0.39
OPRM1 P35372 1/20 0.38
CNR1 P21554 1/20 0.38
CNR2 P34972 1/20 0.38
SMPD1 P17405 3/20 0.37
FDPS P14324 3/20 0.36
SPHK1 Q9NYA1 1/20 0.36
ZDHHC7 Q9NXF8 1/20 0.36
LMNA P02545 1/20 0.35
DNM1 Q05193 2/20 0.35

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
SCHEMBL14443382 0.85 FAAH (0.40) FAAHOPRM1CNR1CNR2SPHK1
SCHEMBL4022359 0.85 DNM1 (0.48) FAAHOPRM1CNR1CNR2SPHK1
SCHEMBL19219115 0.85 DNM1 (0.48) FAAHOPRM1CNR1CNR2SPHK1
SCHEMBL10350856 0.85 DNM1 (0.48) FAAHOPRM1CNR1CNR2SPHK1
SCHEMBL13500020 0.85 OPRM1 (0.42) FAAHOPRM1CNR1CNR2SMPD1
SCHEMBL11673316 0.85 DNM1 (0.48) FAAHOPRM1CNR1CNR2SPHK1
SCHEMBL3039218 0.85 DNM1 (0.48) FAAHOPRM1CNR1CNR2SPHK1
SCHEMBL7082641 0.85 DNM1 (0.48) FAAHOPRM1CNR1CNR2SPHK1
SCHEMBL7777210 0.85 OPRM1 (0.42) FAAHOPRM1CNR1CNR2SMPD1
SCHEMBL17253503 0.85 DNM1 (0.48) 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
WO-2008055995-A2 METHODS AND COMPOSITIONS FOR DETECTING RECEPTOR LIGAND MIMETICS ALPHAPTOSE GMBH (DE) 2008-05-15 WO disclosed