SCHEMBL8553157

SCHEMBL8553157

CCCCCCCCOc1cnc(-c2ccc3c(c2)CC(CCCCCCCC)C3)nc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 4/20 0.42
KDM4E B2RXH2 4/20 0.42
NPC1 O15118 3/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
HSD17B10 Q99714 2/20 0.42
MAPT P10636 2/20 0.38
RARB P10826 3/20 0.38
PTPN11 Q06124 1/20 0.37
PLA2G2A P14555 1/20 0.37
ALDH1A1 P00352 3/20 0.37
HPGD P15428 3/20 0.37
HTT P42858 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
HTR2A P28223 2/20 0.37
HTR2C P28335 2/20 0.37
HTR1B P28222 1/20 0.37
HTR2B P41595 1/20 0.37
THRB P10828 2/20 0.35
THRA P10827 1/20 0.35
CYP3A4 P08684 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
SCHEMBL8552026 0.95 RAB9A (0.43) RAB9AKDM4ENPC1SMN1; SMN2HSD17B10
SCHEMBL8556698 0.93 RAB9A (0.36) RAB9AKDM4ENPC1SMN1; SMN2HSD17B10
SCHEMBL8553224 0.92 NPC1 (0.45) RAB9AKDM4ENPC1SMN1; SMN2HSD17B10
SCHEMBL8541302 0.90 RAB9A (0.40) RAB9AKDM4ENPC1SMN1; SMN2HSD17B10
SCHEMBL8558587 0.86 FYN (0.36) RAB9AKDM4ENPC1SMN1; SMN2HSD17B10
SCHEMBL8552877 0.86 KDM4E (0.48) RAB9AKDM4EMAPTRARBPTPN11
SCHEMBL8551722 0.85 FYN (0.40) RAB9AKDM4ENPC1SMN1; SMN2HSD17B10
SCHEMBL8542748 0.85 FYN (0.40) RAB9AKDM4ENPC1SMN1; SMN2HSD17B10
SCHEMBL8555728 0.85 CYP3A4 (0.32) RAB9AKDM4ENPC1SMN1; SMN2HSD17B10
SCHEMBL8552427 0.84 RARB (0.50) 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-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