SCHEMBL6451769

SCHEMBL6451769

CCCCCCC1CC[C@@H]2C[C@H](c3ccc(-c4cc(F)c(OC)c(F)c4)cc3)CC[C@@H]2C1

nearest known ligand 0.34

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 4/20 0.34
CNR2 P34972 4/20 0.34
GAA P10253 1/20 0.32
MAPT P10636 1/20 0.32
SPHK1 Q9NYA1 3/20 0.32
MGLL Q99685 3/20 0.31
FSHR P23945 5/20 0.30
RAB9A P51151 1/20 0.30
DGAT1 O75907 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
SCHEMBL6453713 1.00 CNR1 (0.34) CNR1CNR2GAAMAPTSPHK1
SCHEMBL6453707 1.00 CNR1 (0.34) CNR1CNR2GAAMAPTSPHK1
SCHEMBL6451774 1.00 CNR1 (0.34) CNR1CNR2GAAMAPTSPHK1
SCHEMBL6456156 0.99 CNR1 (0.34) CNR1CNR2GAAMAPTSPHK1
SCHEMBL6456151 0.99 CNR1 (0.34) CNR1CNR2GAAMAPTSPHK1
SCHEMBL6457658 0.96 CNR1 (0.35) CNR1CNR2RAB9A
SCHEMBL6457655 0.96 CNR1 (0.35) CNR1CNR2RAB9A
SCHEMBL6455783 0.91 CYP2C9 (0.36) CNR1CNR2MAPT
SCHEMBL6455786 0.91 CYP2C9 (0.36) CNR1CNR2MAPT
SCHEMBL6460299 0.91 GAA (0.33) CNR1CNR2GAAMAPTSPHK1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6913797-B1 Decahydronaphthalene derivative DAINIPPON INK AND CHEMICALS, INC. (JP) 2005-07-05 US disclosed
EP-1108700-A1 DECAHYDRONAPHTHALENE DERIVATIVE DAINIPPON INK AND CHEMICALS, INC. (JP) 2001-06-20 EP disclosed