SCHEMBL10000268

SCHEMBL10000268

CCCCCCCCOc1ccc(-c2ncc(C)cn2)cc1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 5/20 0.67
RAB9A P51151 5/20 0.67
KDM4E B2RXH2 4/20 0.67
SMN1; SMN2 Q16637 2/20 0.67
HSD17B10 Q99714 2/20 0.67
MAPT P10636 1/20 0.58
RARB P10826 3/20 0.55
CYP2C9 P11712 4/20 0.54
CYP2C19 P33261 4/20 0.54
CYP3A4 P08684 2/20 0.54
CYP2D6 P10635 2/20 0.54
ALDH1A1 P00352 3/20 0.53
NR5A1 Q13285 1/20 0.53
HPGD P15428 2/20 0.52
HTT P42858 1/20 0.52
L3MBTL1 Q9Y468 1/20 0.52
TP53 P04637 1/20 0.51
TSHR P16473 1/20 0.51
CYP19A1 P11511 3/20 0.51
PLA2G4B P0C869 1/20 0.50

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
SCHEMBL19387236 1.00 NPC1 (0.67) NPC1RAB9AKDM4ESMN1; SMN2HSD17B10
SCHEMBL13310847 1.00 NPC1 (0.67) NPC1RAB9AKDM4ESMN1; SMN2HSD17B10
SCHEMBL10502311 0.95 NPC1 (0.65) NPC1RAB9AKDM4ESMN1; SMN2HSD17B10
SCHEMBL10000270 0.95 NPC1 (0.73) NPC1RAB9AKDM4ESMN1; SMN2HSD17B10
SCHEMBL13987904 0.90 NPC1 (0.71) NPC1RAB9AKDM4ESMN1; SMN2HSD17B10
SCHEMBL9235626 0.90 NPC1 (0.71) NPC1RAB9AKDM4ESMN1; SMN2HSD17B10
SCHEMBL9239737 0.90 NPC1 (0.71) NPC1RAB9AKDM4ESMN1; SMN2HSD17B10
SCHEMBL6017464 0.90 NPC1 (0.71) NPC1RAB9AKDM4ESMN1; SMN2HSD17B10
SCHEMBL9318472 0.90 NPC1 (0.71) NPC1RAB9AKDM4ESMN1; SMN2HSD17B10
SCHEMBL6017545 0.90 NPC1 (0.71) NPC1RAB9AKDM4ESMN1; 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230250338-A1 COMPOUND AND LIQUID CRYSTAL COMPOSITION THE HONG KONG UNIVERSITY OF SCIENCE AND TECHNOLOGY (CN) 2023-08-10 US disclosed
US-20180216004-A1 LOW BIREFRINGENCE FERROELECTRIC LIQUID CRYSTAL MIXTURES THE HONG KONG UNIVERSITY OF SCIENCE AND TECHNOLOGY (CN) 2018-08-02 US disclosed
US-20140313468-A1 LIQUID CRYSTAL DISPLAY ELEMENT DIC CORPORATION (JP) 2014-10-23 US disclosed
US-8158020-B2 Liquid crystal element, optical path deflecting element, and image displaying apparatus RICOH COMPANY, LTD. (JP) 2012-04-17 US disclosed