SCHEMBL14219685

SCHEMBL14219685

Cc1cc(I)cnc1Nc1c(C(=O)NOCC(O)CO)ccc(F)c1F

nearest known ligand 0.65

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAP2K1 Q02750 18/20 0.65
MAP2K2 P36507 5/20 0.65
MAPK1 P28482 2/20 0.65
BRAF P15056 1/20 0.65
MAP2K5 Q13163 1/20 0.65
PIM1 P11309 1/20 0.45
CAMK2B Q13554 1/20 0.45

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
SCHEMBL14219749 1.00 MAP2K1 (0.65) MAP2K1MAP2K2MAPK1BRAFMAP2K5
SCHEMBL14222548 0.91 MAP2K1 (0.59) MAP2K1MAP2K2MAPK1BRAFMAP2K5
SCHEMBL14219700 0.91 MAP2K1 (0.59) MAP2K1MAP2K2MAPK1BRAFMAP2K5
SCHEMBL14220107 0.91 MAP2K1 (0.67) MAP2K1MAP2K2MAPK1BRAFMAP2K5
SCHEMBL14219741 0.91 MAP2K1 (0.67) MAP2K1MAP2K2MAPK1BRAFMAP2K5
SCHEMBL14223029 0.90 MAP2K1 (0.54) MAP2K1MAP2K2MAPK1BRAFMAP2K5
SCHEMBL14222547 0.90 MAP2K1 (0.58) MAP2K1MAP2K2MAPK1BRAFMAP2K5
SCHEMBL14219613 0.90 MAP2K1 (0.58) MAP2K1MAP2K2MAPK1BRAFMAP2K5
SCHEMBL14219637 0.90 MAP2K1 (0.54) MAP2K1MAP2K2MAPK1BRAFMAP2K5
SCHEMBL14222536 0.89 MAP2K1 (0.58) MAP2K1MAP2K2MAPK1BRAFMAP2K5

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