SCHEMBL8552231

SCHEMBL8552231

CCCCCCCCCCc1ccc(-c2ccc(OS(=O)(=O)C(F)(F)F)cc2)cc1

nearest known ligand 0.52

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
RARB P10826 9/20 0.52
RARA P10276 2/20 0.52
MEN1 O00255 1/20 0.52
ALDH1A1 P00352 1/20 0.52
MAPT P10636 1/20 0.52
MTOR P42345 1/20 0.52
KMT2A Q03164 1/20 0.52
RARG P13631 1/20 0.49
STS P08842 2/20 0.48
FAAH O00519 1/20 0.48
TSHR P16473 1/20 0.47
HSD17B10 Q99714 1/20 0.47
CA2 P00918 1/20 0.45
THRB P10828 2/20 0.45
THRA P10827 1/20 0.45
FUT7 Q11130 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
SCHEMBL7930478 0.94 CA2 (0.50) RARBALDH1A1STSFAAHHSD17B10
SCHEMBL22666338 0.93 CA2 (0.49) RARBALDH1A1STSFAAHHSD17B10
SCHEMBL2829918 0.90 CA2 (0.49) RARBALDH1A1STSFAAHHSD17B10
SCHEMBL19796243 0.88 RARB (0.47) RARBRARAMEN1ALDH1A1MAPT
SCHEMBL27454463 0.88 CA2 (0.47) RARBALDH1A1STSFAAHHSD17B10
SCHEMBL18541205 0.87 RARB (0.53) RARBRARAMEN1ALDH1A1MAPT
SCHEMBL6018128 0.86 MAPT (0.55) RARBRARAMEN1ALDH1A1MAPT
SCHEMBL18541199 0.86 S1PR1 (0.43) RARBRARAMEN1ALDH1A1MAPT
SCHEMBL18541200 0.86 S1PR1 (0.43) RARBRARAMEN1ALDH1A1MAPT
SCHEMBL18541206 0.84 RARB (0.51) RARBRARAMEN1ALDH1A1MAPT

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-0546338-B1 Mesomorphic compound, liquid crystal composition, liquid crystal device, display apparatus and display method CANON KK (JP) 1998-02-04 EP disclosed
US-5385692-A Improved response CANON KABUSHIKI KAISHA (JP) 1995-01-31 US disclosed
EP-0546338-A1 Mesomorphic compound, liquid crystal composition, liquid crystal device, display apparatus and display method CANON KABUSHIKI KAISHA (JP) 1993-06-16 EP disclosed