SCHEMBL8432014

SCHEMBL8432014

CCCCCCCCOc1ccc(-c2cnc(-c3ccc(OCCC(CCCCCC)C(F)(F)F)cc3)nc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 5/20 0.50
KDM4E B2RXH2 5/20 0.50
NPC1 O15118 4/20 0.50
SMN1; SMN2 Q16637 3/20 0.50
HSD17B10 Q99714 2/20 0.50
MAPT P10636 2/20 0.45
RARB P10826 4/20 0.45
CYP3A4 P08684 3/20 0.42
CYP2D6 P10635 3/20 0.42
ALDH1A1 P00352 4/20 0.41
HPGD P15428 3/20 0.41
HTT P42858 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
CYP2C9 P11712 3/20 0.40
CYP2C19 P33261 3/20 0.40
CYP19A1 P11511 2/20 0.40
MEN1 O00255 1/20 0.40
USP2 O75604 1/20 0.40
GAA P10253 1/20 0.40
KMT2A Q03164 1/20 0.40

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
SCHEMBL8436678 0.95 RAB9A (0.50) RAB9AKDM4ENPC1SMN1; SMN2HSD17B10
SCHEMBL9625879 0.87 RARB (0.50) RAB9AKDM4ENPC1SMN1; SMN2HSD17B10
SCHEMBL8432006 0.85 RARB (0.46) RAB9AKDM4ENPC1SMN1; SMN2HSD17B10
SCHEMBL8433914 0.85 RARB (0.46) RAB9AKDM4ENPC1SMN1; SMN2HSD17B10
SCHEMBL9184595 0.83 NPC1 (0.69) RAB9AKDM4ENPC1SMN1; SMN2HSD17B10
SCHEMBL9330768 0.83 NPC1 (0.69) RAB9AKDM4ENPC1SMN1; SMN2HSD17B10
SCHEMBL8436583 0.83 RARB (0.46) RAB9AKDM4ENPC1SMN1; SMN2HSD17B10
SCHEMBL6251962 0.81 RAB9A (0.45) RAB9AKDM4ENPC1SMN1; SMN2HSD17B10
SCHEMBL10468952 0.81 NPC1 (0.52) RAB9AKDM4ENPC1SMN1; SMN2HSD17B10
SCHEMBL10469839 0.81 NPC1 (0.52) RAB9AKDM4ENPC1SMN1; SMN2HSD17B10

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