SCHEMBL8426148

SCHEMBL8426148

COCCCCCCOc1cnc(-c2ccc(OCCCCOCC(F)(F)OC(F)(F)C(F)(F)OC(F)(F)C(F)(F)F)cc2)nc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 4/20 0.38
RAB9A P51151 4/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
KDM4E B2RXH2 2/20 0.38
HSD17B10 Q99714 1/20 0.38
MAPT P10636 2/20 0.35
HDAC1 Q13547 6/20 0.33
HDAC2 Q92769 6/20 0.33
HDAC3 O15379 5/20 0.33
HDAC4 P56524 5/20 0.33
HDAC7 Q8WUI4 5/20 0.33
HDAC10 Q969S8 5/20 0.33
HDAC11 Q96DB2 5/20 0.33
HDAC8 Q9BY41 5/20 0.33
HDAC6 Q9UBN7 5/20 0.33
HDAC9 Q9UKV0 5/20 0.33
HDAC5 Q9UQL6 5/20 0.33
ALDH1A1 P00352 2/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32

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
SCHEMBL8428627 0.94 NPC1 (0.37) NPC1RAB9ASMN1; SMN2KDM4EHSD17B10
SCHEMBL7091626 0.92 NPC1 (0.46) NPC1RAB9ASMN1; SMN2KDM4EHSD17B10
SCHEMBL7088432 0.92 NPC1 (0.46) NPC1RAB9ASMN1; SMN2KDM4EHSD17B10
SCHEMBL8428633 0.92 NPC1 (0.46) NPC1RAB9ASMN1; SMN2KDM4EHSD17B10
SCHEMBL8426227 0.92 NPC1 (0.46) NPC1RAB9ASMN1; SMN2KDM4EHSD17B10
SCHEMBL8428683 0.91 NPC1 (0.45) NPC1RAB9ASMN1; SMN2KDM4EHSD17B10
SCHEMBL8428820 0.90 NPC1 (0.47) NPC1RAB9ASMN1; SMN2KDM4EHSD17B10
SCHEMBL8426361 0.88 NPC1 (0.45) NPC1RAB9ASMN1; SMN2KDM4EHSD17B10
SCHEMBL8426232 0.88 NPC1 (0.45) NPC1RAB9ASMN1; SMN2KDM4EHSD17B10
SCHEMBL8424408 0.87 NPC1 (0.37) NPC1RAB9ASMN1; SMN2KDM4EHSD17B10

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