SCHEMBL8428627

SCHEMBL8428627

COCCOCCOCCOc1cnc(-c2ccc(OCCCCOCC(F)(F)OC(F)(F)C(F)(F)OC(F)(F)C(F)(F)F)cc2)nc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 3/20 0.37
RAB9A P51151 3/20 0.37
KDM4E B2RXH2 2/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
HSD17B10 Q99714 1/20 0.37
RARB P10826 2/20 0.34
MAPT P10636 3/20 0.34
RECQL P46063 1/20 0.34
CBFB Q13951 1/20 0.32
HDAC1 Q13547 1/20 0.32
HDAC2 Q92769 1/20 0.32
CHEK2 O96017 1/20 0.31
RARA P10276 1/20 0.31
L3MBTL1 Q9Y468 2/20 0.31
MEN1 O00255 1/20 0.31
ALDH1A1 P00352 1/20 0.31
KMT2A Q03164 1/20 0.31
AR P10275 1/20 0.31
TSHR P16473 2/20 0.30
CHEK1 O14757 1/20 0.30

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
SCHEMBL8426148 0.94 NPC1 (0.38) NPC1RAB9AKDM4ESMN1; SMN2HSD17B10
SCHEMBL8428820 0.91 NPC1 (0.47) NPC1RAB9AKDM4ESMN1; SMN2HSD17B10
SCHEMBL8426361 0.89 NPC1 (0.45) NPC1RAB9AKDM4ESMN1; SMN2HSD17B10
SCHEMBL8426232 0.89 NPC1 (0.45) NPC1RAB9AKDM4ESMN1; SMN2HSD17B10
SCHEMBL8426227 0.88 NPC1 (0.46) NPC1RAB9AKDM4ESMN1; SMN2HSD17B10
SCHEMBL7091626 0.88 NPC1 (0.46) NPC1RAB9AKDM4ESMN1; SMN2HSD17B10
SCHEMBL7088432 0.88 NPC1 (0.46) NPC1RAB9AKDM4ESMN1; SMN2HSD17B10
SCHEMBL8428633 0.88 NPC1 (0.46) NPC1RAB9AKDM4ESMN1; SMN2HSD17B10
SCHEMBL8428683 0.87 NPC1 (0.45) NPC1RAB9AKDM4ESMN1; SMN2HSD17B10
SCHEMBL7094530 0.85 NPC1 (0.34) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5928562-A HAVING EXTENDED HYDROCARBON ETHER GROUP ADJACENT TO A TERMINAL FLUOROALKYL OR FLUOROETHER GROUP; LOW VISCOSITY; HIGH SPEED RESPONSE; BRIGHTNESS; COMMPATIBILITY; DISPLAYS MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1999-07-27 US disclosed