SCHEMBL9656138

SCHEMBL9656138

C/C(=N/NC(=O)O)c1ccc[nH]1

nearest known ligand 0.64

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 4/20 0.64
RAB9A P51151 4/20 0.64
SMN1; SMN2 Q16637 2/20 0.64
CYP1A2 P05177 2/20 0.64
MAPT P10636 3/20 0.52
MEN1 O00255 2/20 0.52
GAA P10253 2/20 0.52
KMT2A Q03164 2/20 0.52
TDP1 Q9NUW8 2/20 0.52
POLB P06746 2/20 0.52
CTDSP1 Q9GZU7 1/20 0.52
L3MBTL1 Q9Y468 1/20 0.52
ALDH1A1 P00352 2/20 0.45
LMNA P02545 2/20 0.45
MAPK1 P28482 1/20 0.45
TSHR P16473 1/20 0.42
KDM4E B2RXH2 1/20 0.42
CYP2D6 P10635 1/20 0.40

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
SCHEMBL9656144 1.00 NPC1 (0.64) NPC1RAB9ASMN1; SMN2CYP1A2MAPT
SCHEMBL13561199 0.85 CYP1A2 (0.71) NPC1RAB9ASMN1; SMN2CYP1A2MAPT
SCHEMBL940759 0.78 CYP1A2 (1.00) NPC1RAB9ASMN1; SMN2CYP1A2
SCHEMBL942362 0.78 CYP1A2 (1.00) NPC1RAB9ASMN1; SMN2CYP1A2
SCHEMBL5181363 0.75 RAB9A (0.49) NPC1RAB9ASMN1; SMN2CYP1A2MAPT
SCHEMBL14938560 0.72 MAPT (0.78) NPC1RAB9ASMN1; SMN2CYP1A2MAPT
SCHEMBL31688426 0.72 KDM4E (0.51) POLBLMNATSHRKDM4E
SCHEMBL2491802 0.71
SCHEMBL3464105 0.71
SCHEMBL21994249 0.71 CYP1A2 (0.61) NPC1RAB9ASMN1; SMN2CYP1A2MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0299974-B1 ANTHELMINTIC ACYLHYDRAZONES, METHOD OF USE AND COMPOSITIONS THE UPJOHN COMPANY (US) 1992-01-22 EP claimed
EP-0299974-A1 ANTHELMINTIC ACYLHYDRAZONES, METHOD OF USE AND COMPOSITIONS. UPJOHN CO (US) 1989-01-25 EP claimed
WO-1987006127-A1 ANTHELMINTIC ACYLHYDRAZONES, METHOD OF USE AND COMPOSITIONS THE UPJOHN COMPANY (US) 1987-10-22 WO claimed