SCHEMBL8938358

SCHEMBL8938358

C=CCCC1CC=C(c2ccc(-c3ccc(-c4ccc(OCCC)c(F)c4F)cc3)cc2F)CC1

nearest known ligand 0.35

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 2/20 0.35
GABRB2 P47870 2/20 0.35
FFAR4 Q5NUL3 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
SCHEMBL8938471 0.96 CNR2 (0.33) GABRA1GABRB2
SCHEMBL8938476 0.95 GABRA1 (0.33) GABRA1GABRB2
SCHEMBL8938608 0.94 GABRA1 (0.33) GABRA1GABRB2
SCHEMBL8937101 0.94 GABRA1 (0.36) GABRA1GABRB2FFAR4
SCHEMBL8938315 0.94 NAAA (0.33)
SCHEMBL8939372 0.93 GABRA1 (0.37) GABRA1GABRB2
SCHEMBL8937450 0.91 ESR2 (0.32) GABRA1GABRB2FFAR4
SCHEMBL8966679 0.91 GABRA1 (0.33) GABRA1GABRB2
SCHEMBL8938172 0.90 FFAR4 (0.31) GABRA1GABRB2FFAR4
SCHEMBL8937105 0.90 CNR2 (0.33) GABRA1GABRB2

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
EP-2206695-B1 TETRA- OR PENTA-CYCLIC LIQUID CRYSTALLINE COMPOUND HAVING LATERAL FLUORINE, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY ELEMENT JNC CORP (JP) 2013-09-18 EP disclosed
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