SCHEMBL6460019

SCHEMBL6460019

CCCCCCCC1CCC2CC(c3ccc4cc(C(F)(F)F)c(F)cc4c3)CCC2C1

nearest known ligand 0.33

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.33
MAPT P10636 1/20 0.33
SLC6A2 P23975 2/20 0.32
SLC6A4 P31645 2/20 0.32
SLC6A3 Q01959 2/20 0.32
CNR2 P34972 1/20 0.32
CYP3A4 P08684 1/20 0.30
CYP2C8 P10632 1/20 0.30
S1PR3 Q99500 1/20 0.30
KDM1A O60341 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
SCHEMBL6460013 1.00 GAA (0.33) GAAMAPTSLC6A2SLC6A4SLC6A3
SCHEMBL7920014 1.00 GAA (0.33) GAAMAPTSLC6A2SLC6A4SLC6A3
SCHEMBL7920015 1.00 GAA (0.33) GAAMAPTSLC6A2SLC6A4SLC6A3
SCHEMBL6463305 0.99 SLC6A4 (0.32) GAAMAPTSLC6A2SLC6A4SLC6A3
SCHEMBL6463303 0.99 SLC6A4 (0.32) GAAMAPTSLC6A2SLC6A4SLC6A3
SCHEMBL6452429 0.96 SLC6A4 (0.33) GAAMAPTSLC6A2SLC6A4SLC6A3
SCHEMBL6452425 0.96 SLC6A4 (0.33) GAAMAPTSLC6A2SLC6A4SLC6A3
SCHEMBL7911060 0.92 CYP2C9 (0.34) MAPTSLC6A2SLC6A4SLC6A3KDM1A
SCHEMBL7911063 0.92 CYP2C9 (0.34) MAPTSLC6A2SLC6A4SLC6A3KDM1A
SCHEMBL6453164 0.91 SLC6A4 (0.36) GAAMAPTSLC6A2SLC6A4SLC6A3

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