SCHEMBL7215102

SCHEMBL7215102

CNC(=O)/C(=N\OC)c1ccccc1COc1nc(Cl)c(Cl)cc1Cl

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 8/20 0.47
TP53 P04637 1/20 0.36
HTT P42858 1/20 0.36
MRGPRX4 Q96LA9 1/20 0.35
OPRL1 P41146 2/20 0.33
CASP3 P42574 1/20 0.33
SENP8 Q96LD8 1/20 0.33
SENP7 Q9BQF6 1/20 0.33
SENP6 Q9GZR1 1/20 0.33
SCN9A Q15858 1/20 0.33
CNR1 P21554 1/20 0.33
CLCN2 P51788 1/20 0.32

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
SCHEMBL7215106 1.00 HIF1A (0.47) HIF1ATP53HTTMRGPRX4OPRL1
SCHEMBL8368525 0.89 HIF1A (0.45) HIF1AMRGPRX4SCN9A
SCHEMBL8368530 0.89 HIF1A (0.45) HIF1AMRGPRX4SCN9A
SCHEMBL829036 0.86 HIF1A (0.49) HIF1ATP53HTTMRGPRX4SCN9A
SCHEMBL829037 0.86 HIF1A (0.49) HIF1ATP53HTTMRGPRX4SCN9A
SCHEMBL8341973 0.85 HIF1A (0.42) HIF1ATP53HTTMRGPRX4OPRL1
SCHEMBL8341971 0.85 HIF1A (0.42) HIF1ATP53HTTMRGPRX4OPRL1
SCHEMBL8369597 0.84 HIF1A (0.51) HIF1ATP53HTTMRGPRX4CLCN2
SCHEMBL8369599 0.84 HIF1A (0.51) HIF1ATP53HTTMRGPRX4CLCN2
SCHEMBL8337628 0.83 HIF1A (0.45) HIF1ATP53HTTMRGPRX4SCN9A

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
US-6559170-B1 Compounds are useful as fungicides in plants DOW AGROSCIENCE LLC 2003-05-06 US disclosed
EP-1237870-A1 PYRIDINE DERIVATIVES HAVING FUNGICIDAL ACTIVITY AND PROCESSES TO PRODUCE AND USE THE SAME Dow AgroSciences LLC (US) 2002-09-11 EP disclosed
WO-2001044196-A1 PYRIDINE DERIVATIVES HAVING FUNGICIDAL ACTIVITY AND PROCESSES TO PRODUCE AND USE THE SAME DOW AGROSCIENCES, LLC (US) 2001-06-21 WO disclosed