SCHEMBL8946586

SCHEMBL8946586

C=CCCOCc1ccc(-c2ccc(-c3ccc(C4CCC(CCCCCC)OC4)c(F)c3)cc2)c(F)c1F

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GBA1 P04062 2/20 0.33
LCT P09848 2/20 0.33
UGCG Q16739 2/20 0.33
GBA2 Q9HCG7 2/20 0.33
MGAM O43451 1/20 0.33
SI P14410 1/20 0.33

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
SCHEMBL8946609 0.93 GBA1 (0.36) GBA1LCTUGCGGBA2MGAM
SCHEMBL15255955 0.88 GBA1 (0.33) GBA1LCTUGCGGBA2MGAM
SCHEMBL8946566 0.87 GBA1 (0.30) GBA1LCTUGCGGBA2MGAM
SCHEMBL8946258 0.86 RARB (0.30)
SCHEMBL8946285 0.86 RARB (0.30)
SCHEMBL8946232 0.86 RARB (0.30)
SCHEMBL8946356 0.86 RARB (0.30)
SCHEMBL8946240 0.86 RARB (0.30)
SCHEMBL8946234 0.86
SCHEMBL13263236 0.85 GBA1 (0.31) GBA1LCTUGCGGBA2MGAM

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