SCHEMBL23912583

SCHEMBL23912583

CCOC(=O)c1ncc(C(N)=O)cc1Cl

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.48
LMNA P02545 1/20 0.48
ALDH1A1 P00352 3/20 0.47
MAPK1 P28482 2/20 0.47
NPC1 O15118 1/20 0.47
TP53 P04637 1/20 0.47
MAPT P10636 1/20 0.47
XBP1 P17861 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
HSD17B10 Q99714 1/20 0.47
TLR9 Q9NR96 1/20 0.47
JAK2 O60674 1/20 0.43
JAK1 P23458 1/20 0.43
TYK2 P29597 1/20 0.43
JAK3 P52333 1/20 0.43
GLP1R P43220 1/20 0.43
PDE4A P27815 1/20 0.42
PDE4B Q07343 1/20 0.42
PDE4C Q08493 1/20 0.42
PDE4D Q08499 1/20 0.42

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
SCHEMBL15351663 0.89 CYP2C9 (0.51) HTTALDH1A1MAPK1NPC1TP53
SCHEMBL21102374 0.88 ALDH1A1 (0.49) HTTALDH1A1MAPK1NPC1TP53
SCHEMBL519387 0.87 CYP2C9 (0.56) HTTLMNAALDH1A1MAPK1NPC1
SCHEMBL20613721 0.85 ALDH1A1 (0.47) HTTALDH1A1MAPK1NPC1TP53
SCHEMBL31338988 0.83 NNMT (0.42) HTTLMNAALDH1A1MAPK1MAPT
SCHEMBL31338984 0.83 NNMT (0.42) HTTLMNAALDH1A1MAPK1MAPT
SCHEMBL17986785 0.82 ALDH1A1 (0.44) HTTALDH1A1MAPK1NPC1TP53
SCHEMBL17173720 0.81 MAPT (0.51) HTTALDH1A1MAPK1NPC1TP53
SCHEMBL6492223 0.81 MAPT (0.51) HTTALDH1A1MAPK1NPC1TP53
SCHEMBL14831259 0.81 ALDH1A1 (0.51) HTTALDH1A1MAPK1NPC1TP53

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
EP-3564238-B1 FUSED HETEROCYCLIC COMPOUND HAVING OXIME GROUP OR SALTS THEREOF, AGRICULTURAL/HORTICULTURAL INSECTICIDE CONTAINING SAID COMPOUNDS, AND METHOD FOR USING SAID INSECTICIDE NIHON NOHYAKU CO LTD (JP) 2021-10-13 EP disclosed