SCHEMBL9013556

SCHEMBL9013556

CCCCCC1(CCCCC2(c3cccc(F)c3)CCCCC2)CCCCC1

nearest known ligand 0.59

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 14/20 0.59
SLC6A3 Q01959 13/20 0.59
SLC6A2 P23975 7/20 0.59
CNR1 P21554 3/20 0.46
CNR2 P34972 3/20 0.46

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
SCHEMBL12000523 0.84 SLC6A4 (0.66) SLC6A4SLC6A3SLC6A2
SCHEMBL9013661 0.83 SLC6A3 (0.55) SLC6A4SLC6A3SLC6A2CNR1CNR2
SCHEMBL12002369 0.83 SLC6A4 (0.63) SLC6A4SLC6A3SLC6A2
SCHEMBL9013558 0.83 SLC6A3 (0.58) SLC6A4SLC6A3SLC6A2CNR1CNR2
SCHEMBL9013650 0.82 SLC6A3 (0.54) SLC6A4SLC6A3SLC6A2CNR1CNR2
SCHEMBL9013655 0.82 SLC6A3 (0.54) SLC6A4SLC6A3SLC6A2CNR1CNR2
SCHEMBL9013652 0.82 SLC6A3 (0.54) SLC6A4SLC6A3SLC6A2CNR1CNR2
SCHEMBL9013687 0.82 SLC6A3 (0.54) SLC6A4SLC6A3SLC6A2CNR1CNR2
SCHEMBL9013337 0.82 SLC6A3 (0.57) SLC6A4SLC6A3SLC6A2CNR1CNR2
SCHEMBL9013422 0.82 SLC6A3 (0.57) SLC6A4SLC6A3SLC6A2CNR1CNR2

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