SCHEMBL4592315

SCHEMBL4592315

CNC(=O)C(=NOC)c1ccccc1CON=C(CI)c1cccc(OC(F)=Cc2ccccc2)c1

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 8/20 0.43
LMNA P02545 2/20 0.32
HTT P42858 2/20 0.32
KMT2A Q03164 1/20 0.32
ATM Q13315 1/20 0.32
POLB P06746 1/20 0.30
CYP3A4 P08684 1/20 0.30
CYP2D6 P10635 1/20 0.30
MAPT P10636 1/20 0.30
CYP2C9 P11712 1/20 0.30
CYP2C19 P33261 1/20 0.30
NPSR1 Q6W5P4 1/20 0.30

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
SCHEMBL19112233 0.90 HIF1A (0.53) HIF1ALMNAHTTKMT2AATM
SCHEMBL15660633 0.90 HIF1A (0.53) HIF1ALMNAHTTKMT2AATM
SCHEMBL29408787 0.90 HIF1A (0.53) HIF1ALMNAHTTKMT2AATM
SCHEMBL67326 0.90 HIF1A (0.53) HIF1ALMNAHTTKMT2AATM
SCHEMBL14508198 0.90 HIF1A (0.53) HIF1ALMNAHTTKMT2AATM
SCHEMBL67324 0.90 HIF1A (0.53) HIF1ALMNAHTTKMT2AATM
SCHEMBL15660631 0.90 HIF1A (0.53) HIF1ALMNAHTTKMT2AATM
SCHEMBL67325 0.90 HIF1A (0.53) HIF1ALMNAHTTKMT2AATM
SCHEMBL28344253 0.85 HIF1A (0.55) HIF1ALMNAATM
SCHEMBL28344252 0.85 HIF1A (0.55) HIF1ALMNAATM

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-1888535-B1 NEW HETEROCYCLYLETHYLBENZAMIDE DERIVATIVES BAYER CROPSCIENCE SA (FR) 2008-11-19 EP disclosed