SCHEMBL8023055

SCHEMBL8023055

C=C(C(=O)OC)N(C)c1cccc(C(C#N)=NOC)c1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B2 P37059 3/20 0.34
NPC1 O15118 6/20 0.33
RAB9A P51151 6/20 0.33
ALDH1A1 P00352 5/20 0.33
MAPT P10636 4/20 0.33
SMN1; SMN2 Q16637 3/20 0.33
USP30 Q70CQ3 1/20 0.33
HIF1A Q16665 1/20 0.33
HSD17B1 P14061 2/20 0.32
MEN1 O00255 2/20 0.31
KMT2A Q03164 2/20 0.31
KDM4E B2RXH2 2/20 0.31
RXFP1 Q9HBX9 1/20 0.31
MAOA P21397 1/20 0.31
MAOB P27338 1/20 0.31
PLA2G7 Q13093 1/20 0.31
MAPK1 P28482 3/20 0.30
LMNA P02545 1/20 0.30
POLB P06746 1/20 0.30
APP P05067 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
SCHEMBL8010261 0.83 HSD17B2 (0.33) HSD17B2NPC1RAB9AALDH1A1MAPT
SCHEMBL8020173 0.80 GRM5 (0.36) HSD17B2NPC1RAB9AALDH1A1MAPT
SCHEMBL8023961 0.78 MTNR1A (0.34) NPC1RAB9AALDH1A1MAPTSMN1; SMN2
SCHEMBL11781160 0.70 L3MBTL1 (0.43) NPC1RAB9AALDH1A1MAPTSMN1; SMN2
SCHEMBL8019707 0.70 L3MBTL1 (0.42) HSD17B2NPC1RAB9AALDH1A1MAPT
SCHEMBL8019706 0.70 L3MBTL1 (0.42) HSD17B2NPC1RAB9AALDH1A1MAPT
SCHEMBL8020478 0.69 RAB9A (0.35) NPC1RAB9AALDH1A1SMN1; SMN2MEN1
SCHEMBL8020551 0.69 F2 (0.40) NPC1RAB9AALDH1A1MEN1KMT2A
SCHEMBL8020555 0.69 F2 (0.40) NPC1RAB9AALDH1A1MEN1KMT2A
SCHEMBL8500995 0.68 HIF1A (0.43) HSD17B2NPC1RAB9AALDH1A1MAPT

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