SCHEMBL6458412

SCHEMBL6458412

CCCCCCCC1CCC2CC(c3ccc(-c4ccc(OCC(F)(F)F)cc4)cc3)CCC2C1

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 1/20 0.39
GAA P10253 1/20 0.34
MAPT P10636 1/20 0.34
CACNA1G O43497 1/20 0.34
CACNA1H O95180 1/20 0.34
CACNA1I Q9P0X4 1/20 0.34
DRD2 P14416 1/20 0.33
DRD3 P35462 1/20 0.33
S1PR3 Q99500 1/20 0.33
SPHK1 Q9NYA1 2/20 0.33
LIPE Q05469 2/20 0.33
CNR2 P34972 7/20 0.32

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
SCHEMBL6458408 1.00 RAB9A (0.39) RAB9AGAAMAPTCACNA1GCACNA1H
SCHEMBL6458396 1.00 RAB9A (0.39) RAB9AGAAMAPTCACNA1GCACNA1H
SCHEMBL6458389 1.00 RAB9A (0.39) RAB9AGAAMAPTCACNA1GCACNA1H
SCHEMBL6455702 0.99 RAB9A (0.39) RAB9AGAAMAPTCACNA1GCACNA1H
SCHEMBL6455710 0.99 RAB9A (0.39) RAB9AGAAMAPTCACNA1GCACNA1H
SCHEMBL6458220 0.96 RAB9A (0.40) RAB9AGAAMAPTCACNA1GCACNA1H
SCHEMBL6458218 0.96 RAB9A (0.40) RAB9AGAAMAPTCACNA1GCACNA1H
SCHEMBL6452439 0.91 CACNA1G (0.38) RAB9AMAPTCACNA1GCACNA1HCACNA1I
SCHEMBL6452432 0.91 CACNA1G (0.38) RAB9AMAPTCACNA1GCACNA1HCACNA1I
SCHEMBL6452370 0.89 FASN (0.34) RAB9AGAAMAPTDRD2DRD3

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