SCHEMBL32665689

SCHEMBL32665689

C(=Cc1ccccn1)OC=Cc1ccccn1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 3/20 0.68
RAB9A P51151 3/20 0.68
MEN1 O00255 2/20 0.68
KMT2A Q03164 2/20 0.68
ATM Q13315 1/20 0.68
GRM4 Q14833 1/20 0.47
NR4A1 P22736 1/20 0.47
KDM4E B2RXH2 1/20 0.46
GAA P10253 1/20 0.46
MAPT P10636 1/20 0.46
MAPK1 P28482 1/20 0.46
MAOA P21397 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
PTGS1 P23219 1/20 0.43
PTGS2 P35354 1/20 0.43
NFE2L2 Q16236 2/20 0.42
HSP90AA1 P07900 1/20 0.42
ALDH1A1 P00352 1/20 0.41
PKM P14618 1/20 0.41
USP2 O75604 1/20 0.41

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
SCHEMBL4082404 0.82 NPC1 (0.62) NPC1RAB9AMEN1KMT2AATM
SCHEMBL4082402 0.82 NPC1 (0.62) NPC1RAB9AMEN1KMT2AATM
SCHEMBL4098506 0.82 NPC1 (0.62) NPC1RAB9AMEN1KMT2AATM
SCHEMBL229328 0.82 NPC1 (1.00) NPC1RAB9AMEN1KMT2AATM
SCHEMBL31560044 0.82 NPC1 (1.00) NPC1RAB9AMEN1KMT2AATM
SCHEMBL9394256 0.82 NPC1 (1.00) NPC1RAB9AMEN1KMT2AATM
SCHEMBL229329 0.82 NPC1 (1.00) NPC1RAB9AMEN1KMT2AATM
SCHEMBL721182 0.77 MEN1 (0.79) NPC1RAB9AMEN1KMT2AATM
SCHEMBL721181 0.77 MEN1 (0.79) NPC1RAB9AMEN1KMT2AATM
Methyl Alcohol SCHEMBL28478479 0.77 NPC1 (0.89) NPC1RAB9AMEN1KMT2AATM

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
CN-121378178-A Preparation method of 4- (2-furyl) -3-butene-2-ketone 内蒙古源宏精细化工有限公司 2026-01-23 CN disclosed