SCHEMBL8945092

SCHEMBL8945092

CCCCCc1ccc(-c2ccc(-c3ccc(C4CCC(CCCCC)OC4)c(F)c3)cc2)c(F)c1F

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 3/20 0.33
SLC6A4 P31645 3/20 0.33
SLC6A3 Q01959 3/20 0.33
RARB P10826 3/20 0.31
RARA P10276 1/20 0.31
RARG P13631 1/20 0.31

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
SCHEMBL8945713 0.99 RARB (0.33) SLC6A2SLC6A4SLC6A3RARBRARA
SCHEMBL8945451 0.99 RARB (0.33) SLC6A2SLC6A4SLC6A3RARBRARA
SCHEMBL8944999 0.99 RARB (0.33) SLC6A2SLC6A4SLC6A3RARBRARA
SCHEMBL8945591 0.99 RARB (0.33) SLC6A2SLC6A4SLC6A3RARBRARA
SCHEMBL8945360 0.99 RARB (0.33) SLC6A2SLC6A4SLC6A3RARBRARA
SCHEMBL8944961 0.99 RARB (0.33) SLC6A2SLC6A4SLC6A3RARBRARA
SCHEMBL8944984 0.99 RARB (0.33) SLC6A2SLC6A4SLC6A3RARBRARA
SCHEMBL8945537 0.99 RARB (0.33) SLC6A2SLC6A4SLC6A3RARBRARA
SCHEMBL8945705 0.99 RARB (0.33) SLC6A2SLC6A4SLC6A3RARBRARA
SCHEMBL8945221 0.99 RARB (0.33) SLC6A2SLC6A4SLC6A3RARBRARA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8187494-B2 Four- or five-ring liquid crystal compound having lateral fluorine, liquid crystal composition, and liquid crystal display device JNC CORPORATION (JP) 2012-05-29 US disclosed