SCHEMBL9013341

SCHEMBL9013341

CCCCC1(CCCCC2(c3ccc(F)c(F)c3)CCCCC2)CCCCC1

nearest known ligand 0.58

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SLC6A3 Q01959 13/20 0.58
SLC6A4 P31645 12/20 0.58
SLC6A2 P23975 6/20 0.58
CNR2 P34972 5/20 0.47
CNR1 P21554 3/20 0.47
S1PR1 P21453 1/20 0.37
S1PR3 Q99500 1/20 0.37

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
SCHEMBL9013558 0.97 SLC6A3 (0.58) SLC6A3SLC6A4SLC6A2CNR2CNR1
SCHEMBL9013337 0.96 SLC6A3 (0.57) SLC6A3SLC6A4SLC6A2CNR2CNR1
SCHEMBL9013295 0.96 SLC6A3 (0.57) SLC6A3SLC6A4SLC6A2CNR2CNR1
SCHEMBL9013382 0.96 SLC6A3 (0.57) SLC6A3SLC6A4SLC6A2CNR2CNR1
SCHEMBL9013422 0.96 SLC6A3 (0.57) SLC6A3SLC6A4SLC6A2CNR2CNR1
SCHEMBL9013244 0.86 SLC6A3 (0.43) SLC6A3SLC6A4SLC6A2CNR2CNR1
SCHEMBL9013335 0.86 CNR2 (0.44) SLC6A3SLC6A4SLC6A2CNR2CNR1
SCHEMBL9013700 0.85 CNR2 (0.42) SLC6A3SLC6A4SLC6A2CNR2CNR1
SCHEMBL9013692 0.85 SLC6A3 (0.55) SLC6A3SLC6A4SLC6A2CNR2CNR1
SCHEMBL9013347 0.84 CNR1 (0.46) SLC6A3SLC6A4SLC6A2CNR2CNR1

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