SCHEMBL14220148

SCHEMBL14220148

O=C(NOC[C@H](O)CO)c1cc(F)c(F)c(F)c1Nc1ncc(I)cc1I

nearest known ligand 0.55

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MAP2K1 Q02750 19/20 0.55
MAP2K2 P36507 3/20 0.55
BRAF P15056 1/20 0.53
MAPK1 P28482 1/20 0.53
MAP2K5 Q13163 1/20 0.53
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
TDP1 Q9NUW8 1/20 0.41

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
SCHEMBL14219633 1.00 MAP2K1 (0.55) MAP2K1MAP2K2BRAFMAPK1MAP2K5
SCHEMBL14220182 0.91 MAP2K1 (0.66) MAP2K1MAP2K2BRAFMAPK1MAP2K5
SCHEMBL14220145 0.91 MAP2K1 (0.66) MAP2K1MAP2K2BRAFMAPK1MAP2K5
SCHEMBL14223029 0.91 MAP2K1 (0.54) MAP2K1MAP2K2BRAFMAPK1MAP2K5
SCHEMBL14219637 0.91 MAP2K1 (0.54) MAP2K1MAP2K2BRAFMAPK1MAP2K5
SCHEMBL14219854 0.91 MAP2K1 (0.51) MAP2K1MAP2K2BRAFMAPK1MAP2K5
SCHEMBL14220149 0.91 MAP2K1 (0.51) MAP2K1MAP2K2BRAFMAPK1MAP2K5
SCHEMBL14219741 0.90 MAP2K1 (0.67) MAP2K1MAP2K2BRAFMAPK1MAP2K5
SCHEMBL14220107 0.90 MAP2K1 (0.67) MAP2K1MAP2K2BRAFMAPK1MAP2K5
SCHEMBL14219636 0.85 MAP2K1 (0.51) 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 2 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
EP-1908751-A1 N-hydroxy benzamides with antitumour activity EOS S.p.A. (IT) 2008-04-09 EP disclosed