SCHEMBL8368530

SCHEMBL8368530

CNC(=O)C(=NOC)c1ccccc1COc1nc(Cl)c(C(F)(F)F)cc1Cl

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 8/20 0.45
MRGPRX4 Q96LA9 4/20 0.36
PTGES O14684 3/20 0.34
SCN9A Q15858 1/20 0.34
JAK2 O60674 1/20 0.33
NTRK1 P04629 1/20 0.33
TYK2 P29597 1/20 0.33
KDR P35968 1/20 0.33
JAK3 P52333 1/20 0.33
PTK2 Q05397 1/20 0.33
PTK2B Q14289 1/20 0.33
NTRK3 Q16288 1/20 0.33
NTRK2 Q16620 1/20 0.33
SGMS2 Q8NHU3 1/20 0.33

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
SCHEMBL8368525 1.00 HIF1A (0.45) HIF1AMRGPRX4PTGESSCN9AJAK2
SCHEMBL7215102 0.89 HIF1A (0.47) HIF1AMRGPRX4SCN9A
SCHEMBL7215106 0.89 HIF1A (0.47) HIF1AMRGPRX4SCN9A
SCHEMBL8368476 0.85 HIF1A (0.44) HIF1AMRGPRX4JAK2NTRK1TYK2
SCHEMBL8368479 0.85 HIF1A (0.44) HIF1AMRGPRX4JAK2NTRK1TYK2
SCHEMBL8368455 0.85 HIF1A (0.44) HIF1AMRGPRX4PTGESJAK2NTRK1
SCHEMBL8780136 0.85 HIF1A (0.44) HIF1AMRGPRX4JAK2NTRK1TYK2
SCHEMBL8368453 0.85 HIF1A (0.44) HIF1AMRGPRX4PTGESJAK2NTRK1
SCHEMBL8370605 0.84 HIF1A (0.50) HIF1AMRGPRX4SCN9A
SCHEMBL8370602 0.84 HIF1A (0.50) HIF1AMRGPRX4SCN9A

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-0617011-B1 Process for producing alkoxyiminoacetamide compounds SHIONOGI & CO (JP) 1999-01-20 EP disclosed
US-5506358-A USEFUL AS AGRICULTURAL FUNGICIDES SHIONOGI & CO., LTD. (JP) 1996-04-09 US disclosed
EP-0617011-A2 Process for producing alkoxyiminoacetamide compounds SHIONOGI & CO., LTD. (JP) 1994-09-28 EP disclosed