SCHEMBL8956468

SCHEMBL8956468

CCCCCCCOc1ccc(-c2ccc(C(=O)OCC(C)CC)cc2)cc1

nearest known ligand 0.61

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
RARB P10826 3/20 0.61
MAPT P10636 1/20 0.57
TP53 P04637 1/20 0.55
TSHR P16473 1/20 0.55
PLA2G4B P0C869 2/20 0.53
NPC1 O15118 2/20 0.53
LMNA P02545 2/20 0.53
NFKB1 P19838 1/20 0.53
NFKB2 Q00653 1/20 0.53
RELA Q04206 1/20 0.53
SMN1; SMN2 Q16637 1/20 0.53
CYP1A2 P05177 1/20 0.51
CYP3A4 P08684 1/20 0.51
CYP2D6 P10635 1/20 0.51
CYP2C9 P11712 1/20 0.51
CYP2C19 P33261 1/20 0.51
PPARG P37231 2/20 0.49
PPARA Q07869 1/20 0.49
STS P08842 5/20 0.49

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
SCHEMBL9309693 1.00 RARB (0.61) RARBMAPTTP53TSHRPLA2G4B
SCHEMBL10611954 0.96 NPC1 (0.59) RARBMAPTTP53TSHRPLA2G4B
SCHEMBL10612610 0.96 NPC1 (0.59) RARBMAPTTP53TSHRPLA2G4B
SCHEMBL10905823 0.96 NPC1 (0.59) RARBMAPTTP53TSHRPLA2G4B
SCHEMBL10613705 0.96 NPC1 (0.59) RARBMAPTTP53TSHRPLA2G4B
SCHEMBL10614179 0.96 NPC1 (0.59) RARBMAPTTP53TSHRPLA2G4B
SCHEMBL10611962 0.96 NPC1 (0.59) RARBMAPTTP53TSHRPLA2G4B
SCHEMBL10611097 0.96 NPC1 (0.59) RARBMAPTTP53TSHRPLA2G4B
SCHEMBL9502349 0.96 NPC1 (0.59) RARBMAPTTP53TSHRPLA2G4B
SCHEMBL10609524 0.96 NPC1 (0.59) RARBMAPTTP53TSHRPLA2G4B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5550664-A Liquid crystal display device SHARP KABUSHIKI KAISHA (JP) 1996-08-27 US disclosed
US-5529818-A Liquid crystal display device SHARP KABUSHIKI KAISHA (JP) 1996-06-25 US disclosed
EP-0110299-B1 SMECTIC LIQUID CRYSTAL COMPOUNDS AND LIQUID CRYSTAL COMPOSITIONS HITACHI, LTD. (JP) 1988-06-29 EP disclosed
US-4576732-A OPTICAL DISPLAYS HITACHI, LTD. (JP) 1986-03-18 US disclosed
EP-0110299-A2 Smectic liquid crystal compounds and liquid crystal compositions HITACHI, LTD. (JP) 1984-06-13 EP disclosed