SCHEMBL8969305

SCHEMBL8969305

CCCCCCCOc1ccc(-c2ccc(-c3ccc(CCCCC4CCC(CCCCC)CO4)cc3F)cc2)c(F)c1F

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RARB P10826 4/20 0.41
S1PR1 P21453 2/20 0.33
GBA1 P04062 2/20 0.32
LCT P09848 2/20 0.32
UGCG Q16739 2/20 0.32
GBA2 Q9HCG7 2/20 0.32
MGAM O43451 1/20 0.32
SI P14410 1/20 0.32
SLC6A2 P23975 1/20 0.32
SLC6A4 P31645 1/20 0.32
SLC6A3 Q01959 1/20 0.32
MEN1 O00255 2/20 0.32
HTT P42858 2/20 0.32
KMT2A Q03164 2/20 0.32
S1PR2 O95136 1/20 0.32
S1PR3 Q99500 1/20 0.32
LPAR2 Q9HBW0 1/20 0.32
NPC1 O15118 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
MAPT P10636 1/20 0.32

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
SCHEMBL8969201 0.91 RARB (0.38) RARBS1PR1SLC6A2SLC6A4SLC6A3
SCHEMBL8969570 0.91 SLC6A2 (0.39) RARBSLC6A2SLC6A4SLC6A3
SCHEMBL8969819 0.89 RARB (0.42) RARBS1PR1GBA1LCTUGCG
SCHEMBL8969304 0.88 CNR2 (0.34) SLC6A2SLC6A4SLC6A3CNR1CNR2
SCHEMBL8969298 0.88 CNR2 (0.34) SLC6A2SLC6A4SLC6A3CNR1CNR2
SCHEMBL8969239 0.87 CNR2 (0.35) GBA1LCTUGCGGBA2MGAM
SCHEMBL8969535 0.86 RARB (0.39) RARBS1PR1MEN1HTTKMT2A
SCHEMBL8969709 0.84 SLC6A2 (0.34) SLC6A2SLC6A4SLC6A3CNR1CNR2
SCHEMBL9494734 0.83 RARB (0.55) RARBS1PR1MEN1HTTKMT2A
SCHEMBL8944200 0.82 FPR2 (0.35) RARBSLC6A2SLC6A4SLC6A3

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