SCHEMBL8022465

SCHEMBL8022465

CO/C=C(/Oc1cccc(/C(C)=N/O)c1)C(=O)OC

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 6/20 0.42
RAB9A P51151 6/20 0.42
HIF1A Q16665 1/20 0.39
ALDH1A1 P00352 7/20 0.39
SMN1; SMN2 Q16637 3/20 0.39
TP53 P04637 2/20 0.39
HTT P42858 2/20 0.39
MAPT P10636 4/20 0.38
CES2 O00748 1/20 0.38
CES1 P23141 1/20 0.38
ESR1 P03372 1/20 0.37
ESR2 Q92731 1/20 0.37
MTNR1A P48039 1/20 0.37
MTNR1B P49286 1/20 0.37
PRSS1 P07477 1/20 0.37
ACR P10323 1/20 0.37
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
BRAF P15056 1/20 0.36
PARP1 P09874 1/20 0.36

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
SCHEMBL8026283 0.87 NPC1 (0.48) NPC1RAB9AALDH1A1SMN1; SMN2TP53
SCHEMBL8026280 0.87 NPC1 (0.48) NPC1RAB9AALDH1A1SMN1; SMN2TP53
SCHEMBL26418832 0.82 MEN1 (0.47) NPC1RAB9AALDH1A1SMN1; SMN2TP53
SCHEMBL8026084 0.81 PPARG (0.48) NPC1RAB9AHIF1ASMN1; SMN2HPGD
SCHEMBL8026096 0.79 NOTUM (0.37) NPC1RAB9AALDH1A1SMN1; SMN2MAPT
SCHEMBL21647869 0.79 NOTUM (0.37) NPC1RAB9AALDH1A1SMN1; SMN2MAPT
SCHEMBL8026099 0.79 NOTUM (0.37) NPC1RAB9AALDH1A1SMN1; SMN2MAPT
SCHEMBL21675874 0.79 NOTUM (0.37) NPC1RAB9AALDH1A1SMN1; SMN2MAPT
SCHEMBL26418271 0.79 NOTUM (0.37) NPC1RAB9AALDH1A1SMN1; SMN2MAPT
SCHEMBL7695019 0.78 LMNA (0.54) ALDH1A1SMN1; SMN2MAPTMEN1KMT2A

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0975587-A1 OXIME ETHER COMPOUNDS, THEIR USE AND INTERMEDIATES FOR PREPARATIONS OF THE SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2000-02-02 EP disclosed
WO-1998043949-A1 OXIME ETHER COMPOUNDS, THEIR USE AND INTERMEDIATES FOR PREPARATIONS OF THE SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1998-10-08 WO disclosed