SCHEMBL9013335

SCHEMBL9013335

CCCCC1(CCCCC2(c3cc(F)c(F)c(F)c3)CCCCC2)CCCCC1

nearest known ligand 0.44

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 14/20 0.44
CNR1 P21554 7/20 0.42
SLC6A4 P31645 6/20 0.40
SLC6A3 Q01959 6/20 0.40
SLC6A2 P23975 4/20 0.40
GPR55 Q9Y2T6 2/20 0.38

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
SCHEMBL9013458 0.97 CNR2 (0.43) CNR2CNR1SLC6A4SLC6A3SLC6A2
SCHEMBL9247089 0.96 CNR2 (0.45) CNR2CNR1SLC6A4SLC6A3SLC6A2
SCHEMBL9013677 0.96 CNR2 (0.45) CNR2CNR1SLC6A4SLC6A3SLC6A2
SCHEMBL9013370 0.96 CNR2 (0.45) CNR2CNR1SLC6A4SLC6A3SLC6A2
SCHEMBL9013345 0.96 CNR2 (0.45) CNR2CNR1SLC6A4SLC6A3SLC6A2
SCHEMBL9013555 0.87 CNR2 (0.38) CNR2CNR1SLC6A4SLC6A3SLC6A2
SCHEMBL9013341 0.86 SLC6A3 (0.58) CNR2CNR1SLC6A4SLC6A3SLC6A2
SCHEMBL9013691 0.84 CNR2 (0.40) CNR2CNR1SLC6A4SLC6A3SLC6A2
SCHEMBL9013558 0.83 SLC6A3 (0.58) CNR2CNR1SLC6A4SLC6A3SLC6A2
SCHEMBL9013598 0.83 CNR2 (0.42) CNR2CNR1SLC6A4SLC6A3SLC6A2

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0568040-B1 Cyclohexane derivative and liquid crystal composition containing the same CHISSO CORP (JP) 1996-12-04 EP disclosed
US-5468421-A Cyclohexane derivative and liquid crystal composition containing the same CHISSO CORPORATION (JP) 1995-11-21 US disclosed
EP-0568040-A1 Cyclohexane derivative and liquid crystal composition containing the same CHISSO CORPORATION (JP) 1993-11-03 EP disclosed