SCHEMBL6464919

SCHEMBL6464919

CCCCCC1CCC2CC(c3ccc(-c4cc(F)c(OC(F)(F)C(F)F)c(F)c4)cc3)CCC2C1

nearest known ligand 0.34

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.32
MAPT P10636 1/20 0.32
CNR2 P34972 2/20 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
SCHEMBL6464915 1.00 GAA (0.32) GAAMAPTCNR2
SCHEMBL6464015 0.99 GAA (0.33) GAAMAPTCNR2
SCHEMBL6458807 0.99 GAA (0.33) GAAMAPTCNR2
SCHEMBL6458813 0.99 GAA (0.33) GAAMAPTCNR2
SCHEMBL6464009 0.99 GAA (0.33) GAAMAPTCNR2
SCHEMBL6456629 0.97 ESR2 (0.32)
SCHEMBL6456624 0.97 ESR2 (0.32)
SCHEMBL6451900 0.93 CYP2C9 (0.34) MAPT
SCHEMBL6451904 0.93 CYP2C9 (0.34) MAPT
SCHEMBL6460320 0.91 GAA (0.31) GAAMAPTCNR2

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