SCHEMBL14220149

SCHEMBL14220149

O=C(NOCC(O)CO)c1cc(Cl)c(F)c(F)c1Nc1ncc(I)cc1I

nearest known ligand 0.51

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MAP2K1 Q02750 20/20 0.51
MAP2K2 P36507 3/20 0.51
BRAF P15056 1/20 0.49
MAPK1 P28482 1/20 0.49
MAP2K5 Q13163 1/20 0.49

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
SCHEMBL14219854 1.00 MAP2K1 (0.51) MAP2K1MAP2K2BRAFMAPK1MAP2K5
SCHEMBL14219850 0.91 MAP2K1 (0.50) MAP2K1MAP2K2BRAFMAPK1MAP2K5
SCHEMBL14220148 0.91 MAP2K1 (0.55) MAP2K1MAP2K2BRAFMAPK1MAP2K5
SCHEMBL14219633 0.91 MAP2K1 (0.55) MAP2K1MAP2K2BRAFMAPK1MAP2K5
SCHEMBL14220145 0.89 MAP2K1 (0.66) MAP2K1MAP2K2BRAFMAPK1MAP2K5
SCHEMBL14220182 0.89 MAP2K1 (0.66) MAP2K1MAP2K2BRAFMAPK1MAP2K5
SCHEMBL14219741 0.86 MAP2K1 (0.67) MAP2K1MAP2K2BRAFMAPK1MAP2K5
SCHEMBL14220107 0.86 MAP2K1 (0.67) MAP2K1MAP2K2BRAFMAPK1MAP2K5
SCHEMBL14222510 0.86 MAP2K1 (0.47) MAP2K1MAP2K2BRAFMAPK1MAP2K5
SCHEMBL14219745 0.85 MAP2K1 (0.49) MAP2K1MAP2K2BRAFMAPK1MAP2K5

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-1908751-A1 N-hydroxy benzamides with antitumour activity EOS S.p.A. (IT) 2008-04-09 EP disclosed