SCHEMBL8970923

SCHEMBL8970923

CCCCCC1CCC(OCc2ccc(-c3ccc(-c4ccc(OC)c(F)c4F)cc3)c(F)c2)CO1

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 4/20 0.38
DRD4 P21917 6/20 0.37
SIGMAR1 Q99720 6/20 0.37
TMEM97 Q5BJF2 3/20 0.37
SLC6A2 P23975 4/20 0.36
SLC6A4 P31645 4/20 0.36
SLC6A3 Q01959 4/20 0.36
ABCB1 P08183 2/20 0.34
RARB P10826 1/20 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

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
SCHEMBL12760016 0.86 NAAA (0.33) NAAA
SCHEMBL8969570 0.86 SLC6A2 (0.39) SLC6A2SLC6A4SLC6A3RARB
SCHEMBL12760022 0.85 NAAA (0.33) NAAA
SCHEMBL8943565 0.83 SLC6A2 (0.37) SLC6A2SLC6A4SLC6A3
SCHEMBL8972042 0.83 SLC6A2 (0.34) SLC6A2SLC6A4SLC6A3
SCHEMBL8971343 0.83 RARB (0.39) SLC6A2SLC6A4SLC6A3RARB
SCHEMBL12760014 0.83 NAAA (0.34) NAAA
SCHEMBL8943998 0.83 FPR2 (0.36) SLC6A2SLC6A4SLC6A3
SCHEMBL12760021 0.82 NAAA (0.33) NAAA
SCHEMBL8970729 0.81 NAAA (0.45) NAAASLC6A2SLC6A4SLC6A3GBA1

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