SCHEMBL9768784

SCHEMBL9768784

CN(N=Cc1ccccn1)C(=O)O

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.57
G6PC1 P35575 1/20 0.56
NPC1 O15118 4/20 0.50
RAB9A P51151 4/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
LMNA P02545 2/20 0.50
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.49
MAOA P21397 2/20 0.49
MAOB P27338 1/20 0.48
NR4A1 P22736 1/20 0.46
KDM4E B2RXH2 4/20 0.46
ALDH1A1 P00352 1/20 0.46
HPGD P15428 1/20 0.46
HSD17B10 Q99714 1/20 0.46
OPRK1 P41145 1/20 0.43
HTT P42858 1/20 0.43
TOP2A P11388 1/20 0.43
CYP1A2 P05177 1/20 0.43

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
SCHEMBL9768782 1.00 USP2 (0.57) USP2G6PC1NPC1RAB9ASMN1; SMN2
SCHEMBL3489173 0.80 USP2 (0.53) USP2G6PC1NPC1RAB9ASMN1; SMN2
SCHEMBL9769017 0.80 G6PC1 (0.56) USP2G6PC1NPC1RAB9ASMN1; SMN2
SCHEMBL3489176 0.80 USP2 (0.53) USP2G6PC1NPC1RAB9ASMN1; SMN2
SCHEMBL9769019 0.80 G6PC1 (0.56) USP2G6PC1NPC1RAB9ASMN1; SMN2
SCHEMBL14517008 0.79 USP2 (0.62) USP2G6PC1NPC1RAB9ASMN1; SMN2
SCHEMBL22862043 0.79 USP2 (0.62) USP2G6PC1NPC1RAB9ASMN1; SMN2
SCHEMBL11637392 0.78 USP2 (0.57) USP2G6PC1NPC1RAB9ASMN1; SMN2
SCHEMBL3943694 0.77 USP2 (0.70) USP2G6PC1NPC1RAB9ASMN1; SMN2
SCHEMBL3943697 0.77 USP2 (0.70) USP2G6PC1NPC1RAB9ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5023334-A Anthelmintic pyridinyl acylhydrazones THE UPJOHN COMPANY (US) 1991-06-11 US claimed
EP-0214158-A1 ANTHELMINTIC PYRIDINYL ACYLHYDRAZONES, METHOD OF USE AND COMPOSITIONS THE UPJOHN COMPANY (US) 1987-03-18 EP claimed
WO-1986004582-A1 ANTHELMINTIC PYRIDINYL ACYLHYDRAZONES, METHOD OF USE AND COMPOSITIONS THE UPJOHN COMPANY (US) 1986-08-14 WO claimed
US-5011932-A Anthelmintic pyridinyl acylhydrazones derivatives UPJOHN COMPANY (US) 1991-04-30 US disclosed