SCHEMBL8970756

SCHEMBL8970756

CCCCCCC1CCC(OCc2ccc(-c3ccc(-c4ccc(OCC)c(F)c4F)cc3)c(F)c2)OC1

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
RARB P10826 1/20 0.33
NAAA Q02083 2/20 0.31
FFAR4 Q5NUL3 1/20 0.31
GBA1 P04062 2/20 0.31
LCT P09848 2/20 0.31
UGCG Q16739 2/20 0.31
GBA2 Q9HCG7 2/20 0.31
MGAM O43451 1/20 0.31
SI P14410 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
SCHEMBL12760033 0.93 FFAR4 (0.32) NAAAFFAR4
SCHEMBL12760032 0.90 FFAR4 (0.32) NAAAFFAR4
SCHEMBL8971187 0.89 NAAA (0.41) NAAAGBA1LCTUGCGGBA2
SCHEMBL12760048 0.88 MEN1 (0.31) NAAA
SCHEMBL8971110 0.88 NAAA (0.33) NAAA
SCHEMBL8970930 0.88 NAAA (0.33) NAAA
SCHEMBL12760030 0.86 FFAR4 (0.33) NAAAFFAR4
SCHEMBL12760047 0.86 MEN1 (0.32) NAAA
SCHEMBL8969201 0.85 RARB (0.38) RARBFFAR4
SCHEMBL13000014 0.85 GRM2 (0.34) NAAAFFAR4GBA1LCTUGCG

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