SCHEMBL7775263

SCHEMBL7775263

CCCCCCCCOc1ccc(N2CC(c3ccc(CCCCCC)cc3)OC2=O)cc1

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 12/20 0.50
S1PR1 P21453 5/20 0.43
S1PR3 Q99500 4/20 0.43
S1PR5 Q9H228 4/20 0.43
MEN1 O00255 1/20 0.43
USP2 O75604 1/20 0.43
ALDH1A1 P00352 1/20 0.43
LMNA P02545 1/20 0.43
CYP3A4 P08684 1/20 0.43
MAPK1 P28482 1/20 0.43
CASP1 P29466 1/20 0.43
KMT2A Q03164 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
SLCO1B3 Q9NPD5 1/20 0.43
SLCO1B1 Q9Y6L6 1/20 0.43

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
SCHEMBL7775123 1.00 GRM2 (0.50) GRM2S1PR1S1PR3S1PR5MEN1
SCHEMBL7776959 0.98 GRM2 (0.50) GRM2S1PR1S1PR3S1PR5
SCHEMBL7778041 0.91 GRM2 (0.52) GRM2S1PR1
SCHEMBL7770531 0.90 GRM2 (0.62) GRM2MEN1KMT2A
SCHEMBL7776796 0.90 GRM2 (0.51) GRM2S1PR1
SCHEMBL7770572 0.88 GRM2 (0.54) GRM2
SCHEMBL7775308 0.86 GRM2 (0.58) GRM2MEN1KMT2A
SCHEMBL7775406 0.85 GRM2 (0.56) GRM2S1PR1
SCHEMBL7775071 0.81 GRM2 (0.57) GRM2ALDH1A1LMNACYP3A4
SCHEMBL7770542 0.76 GRM2 (0.48) GRM2

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0683158-B1 Optically active compound, liquid crystal composition containing the compound, liquid crystal device using the composition, liquid crystal apparatus and display method CANON KK (JP) 2001-08-16 EP disclosed
US-5624600-A Optically active compound, liquid crystal composition containing the compound, liquid crystal device using the composition, liquid crystal apparatus and display method CANON KABUSHIKI KAISHA (JP) 1997-04-29 US disclosed
EP-0683158-A2 Optically active compound, liquid crystal composition containing the compound, liquid crystal device using the composition, liquid crystal apparatus and display method CANON KABUSHIKI KAISHA (JP) 1995-11-22 EP disclosed