SCHEMBL8524775

SCHEMBL8524775

O=c1nc(-c2ccccn2)[nH]nc1-c1ccccc1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 4/20 0.63
RAB9A P51151 4/20 0.63
SMN1; SMN2 Q16637 4/20 0.63
L3MBTL1 Q9Y468 3/20 0.55
ALPL P05186 1/20 0.55
PKM P14618 1/20 0.55
ALOX15 P16050 1/20 0.55
HSD17B10 Q99714 1/20 0.55
TDP1 Q9NUW8 1/20 0.55
KDM4E B2RXH2 1/20 0.52
BTK Q06187 1/20 0.51
F2 P00734 2/20 0.50
F12 P00748 2/20 0.50
PLAU P00749 1/20 0.50
NOTUM Q6P988 1/20 0.47
HTT P42858 3/20 0.46
ALDH1A1 P00352 2/20 0.46
LMNA P02545 1/20 0.46
GAA P10253 1/20 0.46
HIF1A Q16665 1/20 0.46

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
SCHEMBL8525086 0.97 RAB9A (0.60) NPC1RAB9ASMN1; SMN2L3MBTL1ALPL
SCHEMBL8524927 0.89 NPC1 (0.50) NPC1RAB9ASMN1; SMN2L3MBTL1ALPL
SCHEMBL8525315 0.89 NPC1 (0.50) NPC1RAB9ASMN1; SMN2L3MBTL1ALPL
SCHEMBL11281996 0.88 NPC1 (0.50) NPC1RAB9ASMN1; SMN2L3MBTL1ALPL
SCHEMBL8041608 0.85 L3MBTL1 (0.48) NPC1RAB9ASMN1; SMN2L3MBTL1ALPL
SCHEMBL8525649 0.85 NPC1 (0.47) NPC1RAB9ASMN1; SMN2L3MBTL1ALPL
SCHEMBL8525304 0.85 NPC1 (0.50) NPC1RAB9ASMN1; SMN2L3MBTL1ALPL
SCHEMBL8525257 0.85 SMN1; SMN2 (0.49) NPC1RAB9ASMN1; SMN2L3MBTL1ALPL
SCHEMBL8526088 0.84 NPC1 (0.49) NPC1RAB9ASMN1; SMN2L3MBTL1ALPL
SCHEMBL8525516 0.82 PIM1 (0.49) NPC1RAB9ASMN1; SMN2L3MBTL1ALPL

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
WO-1999007352-A2 METHOD FOR PROMOTING EXPRESSION OF LDL RECEPTOR GENE SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 1999-02-18 WO claimed