SCHEMBL6457487

SCHEMBL6457487

C/C=C/COc1ccc2cc([C@@H]3CC[C@@H]4CC(CCCCCCC)CCC4C3)ccc2c1

nearest known ligand 0.33

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 2/20 0.33
SLC6A4 P31645 2/20 0.33
SLC6A3 Q01959 2/20 0.33
RAB9A P51151 1/20 0.33
GAA P10253 1/20 0.31
MAPT P10636 1/20 0.31
S1PR1 P21453 4/20 0.30
S1PR4 O95977 1/20 0.30
S1PR5 Q9H228 1/20 0.30
THRA P10827 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
SCHEMBL6457497 1.00 SLC6A2 (0.33) SLC6A2SLC6A4SLC6A3RAB9AGAA
SCHEMBL6453417 1.00 SLC6A2 (0.33) SLC6A2SLC6A4SLC6A3RAB9AGAA
SCHEMBL6453411 1.00 SLC6A2 (0.33) SLC6A2SLC6A4SLC6A3RAB9AGAA
SCHEMBL6457493 1.00 SLC6A2 (0.33) SLC6A2SLC6A4SLC6A3RAB9AGAA
SCHEMBL6453407 1.00 SLC6A2 (0.33) SLC6A2SLC6A4SLC6A3RAB9AGAA
SCHEMBL6455837 0.99 SLC6A2 (0.33) SLC6A2SLC6A4SLC6A3RAB9A
SCHEMBL6455842 0.99 SLC6A2 (0.33) SLC6A2SLC6A4SLC6A3RAB9A
SCHEMBL6455833 0.99 SLC6A2 (0.33) SLC6A2SLC6A4SLC6A3RAB9A
SCHEMBL6458904 0.96 SLC6A4 (0.34) SLC6A2SLC6A4SLC6A3RAB9A
SCHEMBL6458913 0.96 SLC6A4 (0.34) SLC6A2SLC6A4SLC6A3RAB9A

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