SCHEMBL8668283

SCHEMBL8668283

CCCCCCCCCCOc1cnc(-c2ccc(C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)cc2)nc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 5/20 0.46
KDM4E B2RXH2 5/20 0.46
NPC1 O15118 4/20 0.46
SMN1; SMN2 Q16637 3/20 0.46
HSD17B10 Q99714 2/20 0.46
MAPT P10636 2/20 0.41
RARB P10826 4/20 0.39
ALDH1A1 P00352 4/20 0.39
HPGD P15428 3/20 0.39
MEN1 O00255 1/20 0.39
USP2 O75604 1/20 0.39
GAA P10253 1/20 0.39
KMT2A Q03164 1/20 0.39
HTT P42858 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
CYP2C9 P11712 2/20 0.36
CYP2C19 P33261 2/20 0.36
CYP19A1 P11511 1/20 0.36
NR5A1 Q13285 1/20 0.35
TP53 P04637 1/20 0.35

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
SCHEMBL8665626 0.84 RARB (0.54) RAB9AKDM4ENPC1SMN1; SMN2HSD17B10
SCHEMBL8665862 0.84 RARB (0.54) RAB9AKDM4ENPC1SMN1; SMN2HSD17B10
SCHEMBL8665427 0.84 RARB (0.54) RAB9AKDM4ENPC1SMN1; SMN2HSD17B10
SCHEMBL8742470 0.80 RAB9A (0.55) RAB9AKDM4ENPC1SMN1; SMN2HSD17B10
SCHEMBL7106714 0.79 NPC1 (0.45) RAB9AKDM4ENPC1SMN1; SMN2HSD17B10
SCHEMBL9235626 0.78 NPC1 (0.71) RAB9AKDM4ENPC1SMN1; SMN2HSD17B10
SCHEMBL6017464 0.78 NPC1 (0.71) RAB9AKDM4ENPC1SMN1; SMN2HSD17B10
SCHEMBL5866494 0.78 NPC1 (0.71) RAB9AKDM4ENPC1SMN1; SMN2HSD17B10
SCHEMBL13987904 0.78 NPC1 (0.71) RAB9AKDM4ENPC1SMN1; SMN2HSD17B10
SCHEMBL5866522 0.78 NPC1 (0.71) 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-0644249-B1 Optically inactive, mesomorphic compound, liquid crystal composition containing the compound, liquid crystal device using the compositon, liquid crystal apparatus and display method CANON KK (JP) 1998-12-09 EP disclosed
US-5593616-A DISPOSED BETWEEN PAIR OF SUBSTRATES; GOOD DISPLAY CHARACTERISTICS CANON KABUSHIKI KAISHA (JP) 1997-01-14 US disclosed
EP-0644249-A1 Optically inactive, mesomorphic compound, liquid crystal composition containing the compound, liquid crystal device using the compositon, liquid crystal apparatus and display method CANON KABUSHIKI KAISHA (JP) 1995-03-22 EP disclosed