SCHEMBL4596340

SCHEMBL4596340

O=C(NOCCO)c1ccc(F)c(F)c1Nc1ncc(Cl)cc1Cl

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAP2K1 Q02750 17/20 0.64
MAP2K2 P36507 5/20 0.58
CSNK2A2 P19784 2/20 0.46
RAF1 P04049 1/20 0.46
PDGFRB P09619 1/20 0.46
CSNK2B P67870 1/20 0.46
CSNK2A1 P68400 1/20 0.46
CSNK2A3 Q8NEV1 1/20 0.46
AURKC Q9UQB9 1/20 0.46
CAMK2A Q9UQM7 1/20 0.46
PIM1 P11309 1/20 0.46
CAMK2B Q13554 1/20 0.46
SMC2 O95347 1/20 0.45
EGFR P00533 1/20 0.45
SMC1A Q14683 1/20 0.45
AAK1 Q2M2I8 1/20 0.45
Q6ZSR9 Q6ZSR9 1/20 0.45
BMP2K Q9NSY1 1/20 0.45
CYP2C9 P11712 2/20 0.44
CYP2C19 P33261 2/20 0.44

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
SCHEMBL14219611 0.90 MAP2K1 (0.62) MAP2K1MAP2K2CSNK2A2RAF1PDGFRB
SCHEMBL14219705 0.89 MAP2K1 (0.59) MAP2K1MAP2K2CSNK2A2RAF1PDGFRB
SCHEMBL14222511 0.88 MAP2K1 (0.49) MAP2K1MAP2K2CSNK2A2SMC2EGFR
SCHEMBL14222842 0.88 MAP2K1 (0.48) MAP2K1MAP2K2CSNK2A2RAF1PDGFRB
SCHEMBL4596382 0.87 MAP2K1 (0.49) MAP2K1MAP2K2CSNK2A2RAF1PDGFRB
SCHEMBL4596561 0.86 MAP2K1 (0.60) MAP2K1MAP2K2CSNK2A2RAF1PDGFRB
SCHEMBL4596558 0.86 MAP2K1 (0.60) MAP2K1MAP2K2CSNK2A2RAF1PDGFRB
SCHEMBL4596552 0.86 MAP2K1 (0.60) MAP2K1MAP2K2CSNK2A2RAF1PDGFRB
SCHEMBL14222840 0.85 MAP2K1 (0.44) MAP2K1MAP2K2CSNK2A2RAF1PDGFRB
SCHEMBL14223220 0.84 MAP2K1 (0.49) MAP2K1MAP2K2CSNK2A2SMC2EGFR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2008041088-A2 N-HYDROXY BENZAMIDES WITH ANTITUMOR ACTIVITY EOS (ETHICAL ONCOLOGY SCIENCE) S.P.A. (IT) 2008-04-10 WO disclosed
WO-2008041088-A2 N-HYDROXY BENZAMIDES WITH ANTITUMOR ACTIVITY EOS (ETHICAL ONCOLOGY SCIENCE) S.P.A. (IT) 2008-04-10 WO disclosed
EP-1908751-A1 N-hydroxy benzamides with antitumour activity EOS S.p.A. (IT) 2008-04-09 EP disclosed
EP-1908751-A1 N-hydroxy benzamides with antitumour activity EOS S.p.A. (IT) 2008-04-09 EP disclosed