SCHEMBL6453799

SCHEMBL6453799

CCCCCCC1CCC2CC(c3ccc4cc(OC)ccc4c3)CCC2C1

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 2/20 0.46
SLC6A4 P31645 2/20 0.46
SLC6A3 Q01959 2/20 0.46
RAB9A P51151 1/20 0.34
GAA P10253 1/20 0.34
MAPT P10636 1/20 0.34
DRD2 P14416 2/20 0.34
GRM2 Q14416 2/20 0.34
CNR1 P21554 1/20 0.34
CNR2 P34972 1/20 0.34
SLC10A2 Q12908 1/20 0.33
S1PR1 P21453 4/20 0.33
S1PR4 O95977 1/20 0.33
S1PR5 Q9H228 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2C8 P10632 1/20 0.33
S1PR3 Q99500 1/20 0.33
BCHE P06276 1/20 0.33
ACHE P22303 1/20 0.33

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
SCHEMBL6460252 1.00 SLC6A2 (0.46) SLC6A2SLC6A4SLC6A3RAB9AGAA
SCHEMBL6460257 1.00 SLC6A2 (0.46) SLC6A2SLC6A4SLC6A3RAB9AGAA
SCHEMBL6453793 1.00 SLC6A2 (0.46) SLC6A2SLC6A4SLC6A3RAB9AGAA
SCHEMBL6460720 0.99 SLC6A4 (0.47) SLC6A2SLC6A4SLC6A3RAB9AGAA
SCHEMBL6460724 0.99 SLC6A4 (0.47) SLC6A2SLC6A4SLC6A3RAB9AGAA
SCHEMBL6455960 0.95 SLC6A4 (0.48) SLC6A2SLC6A4SLC6A3RAB9ADRD2
SCHEMBL6455958 0.95 SLC6A4 (0.48) SLC6A2SLC6A4SLC6A3RAB9ADRD2
SCHEMBL6454696 0.91 SLC6A4 (0.50) SLC6A2SLC6A4SLC6A3MAPTDRD2
SCHEMBL6454695 0.91 SLC6A4 (0.50) SLC6A2SLC6A4SLC6A3MAPTDRD2
SCHEMBL6459424 0.91 SLC6A4 (0.50) SLC6A2SLC6A4SLC6A3MAPTDRD2

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