SCHEMBL8432006

SCHEMBL8432006

CCCCCCCCOc1ccc(-c2cnc(-c3ccc(OC(=O)CC(CCCCCC)C(F)(F)F)cc3)nc2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RARB P10826 5/20 0.46
NPC1 O15118 8/20 0.43
SMN1; SMN2 Q16637 4/20 0.43
LMNA P02545 4/20 0.43
NFKB1 P19838 3/20 0.43
NFKB2 Q00653 3/20 0.43
RELA Q04206 3/20 0.43
RAB9A P51151 5/20 0.43
MAPT P10636 2/20 0.43
KDM4E B2RXH2 2/20 0.43
HSD17B10 Q99714 2/20 0.43
POLB P06746 1/20 0.43
LTA4H P09960 1/20 0.42
CYP1A2 P05177 1/20 0.42
CYP3A4 P08684 1/20 0.42
CYP2D6 P10635 1/20 0.42
CYP2C9 P11712 1/20 0.42
CYP2C19 P33261 1/20 0.42
ALDH1A1 P00352 1/20 0.41
TP53 P04637 1/20 0.41

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
SCHEMBL8433914 1.00 RARB (0.46) RARBNPC1SMN1; SMN2LMNANFKB1
SCHEMBL8436583 0.98 RARB (0.46) RARBNPC1SMN1; SMN2LMNANFKB1
SCHEMBL8434200 0.95 RARB (0.45) RARBNPC1SMN1; SMN2LMNANFKB1
SCHEMBL8433923 0.95 RARB (0.45) RARBNPC1SMN1; SMN2LMNANFKB1
SCHEMBL8435596 0.91 RARB (0.46) RARBSMN1; SMN2RAB9AMAPTKDM4E
SCHEMBL9625052 0.90 RARB (0.51) RARBNPC1SMN1; SMN2LMNANFKB1
SCHEMBL8432234 0.87 KMT2A (0.43) RARBNPC1SMN1; SMN2LMNANFKB1
SCHEMBL9624326 0.86 RARB (0.54) RARBNPC1SMN1; SMN2NFKB1NFKB2
SCHEMBL10427488 0.86 RARB (0.50) RARBNPC1SMN1; SMN2LMNANFKB1
SCHEMBL8432014 0.85 RAB9A (0.50) RARBNPC1SMN1; SMN2RAB9AMAPT

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-0499221-B1 Optically active compound, liquid crystal composition, liquid crystal device, display apparatus and display method CANON KK (JP) 1999-12-08 EP disclosed
US-5281362-A Ferroelectric liquid crystals for optics CANON KABUSHIKI KAISHA (JP) 1994-01-25 US disclosed
EP-0499221-A1 Optically active compound, liquid crystal composition, liquid crystal device, display apparatus and display method CANON KABUSHIKI KAISHA (JP) 1992-08-19 EP disclosed