SCHEMBL14724259

SCHEMBL14724259

CCCCc1ccc(N2c3ccc(C(C)(C)C)cc3Oc3cc(C(C)(C)CCC)ccc32)cc1

nearest known ligand 0.38

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 9/20 0.38
CNR1 P21554 6/20 0.38
MGLL Q99685 2/20 0.38
FAAH O00519 1/20 0.38
SIGMAR1 Q99720 4/20 0.33
DRD3 P35462 1/20 0.33
KCNH2 Q12809 1/20 0.32
STS P08842 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
SCHEMBL12786788 0.96 CNR2 (0.40) CNR2CNR1MGLLFAAHDRD3
SCHEMBL13354849 0.95 CNR2 (0.39) CNR2CNR1MGLLFAAHDRD3
SCHEMBL12644165 0.93 CNR2 (0.38) CNR2CNR1MGLLFAAHDRD3
SCHEMBL12433818 0.93 MGLL (0.40) MGLLFAAHSIGMAR1KCNH2STS
SCHEMBL10354395 0.91 CNR2 (0.41) CNR2CNR1MGLLFAAHDRD3
SCHEMBL14870477 0.88 MGLL (0.38) CNR2CNR1MGLLFAAHSIGMAR1
SCHEMBL19996768 0.88 CNR2 (0.43) CNR2CNR1MGLLFAAH
SCHEMBL13460350 0.83 MGLL (0.38) MGLLFAAHSIGMAR1
SCHEMBL14981044 0.83 CNR2 (0.37) CNR2CNR1MGLLFAAH
SCHEMBL10118840 0.81 UCHL3 (0.38) CNR2CNR1MGLLFAAH

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
US-8384066-B2 Polymer light-emitting device, polymer compound, composition, liquid composition, and conductive thin film SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2013-02-26 US disclosed