SCHEMBL6529013

SCHEMBL6529013

CCOC(=O)c1c[nH]c(=O)cc1Nc1ccc(I)cc1F.CCOC(=O)c1cnc(Cl)cc1Nc1ccc(I)cc1F

nearest known ligand 0.56

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
MAP2K1 Q02750 19/20 0.56
MAP2K2 P36507 12/20 0.56

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
SCHEMBL5622895 0.91 MAP2K1 (0.61) MAP2K1MAP2K2
SCHEMBL5623631 0.90 MAP2K1 (0.68) MAP2K1MAP2K2
SCHEMBL6505710 0.87 MAP2K1 (0.57) MAP2K1MAP2K2
SCHEMBL6528655 0.86 MAP2K1 (0.63) MAP2K1MAP2K2
SCHEMBL5624190 0.81 MAP2K2 (0.50) MAP2K1MAP2K2
SCHEMBL3873690 0.81 TP53 (0.49) MAP2K1MAP2K2
SCHEMBL5623906 0.81 THRB (0.49) MAP2K1MAP2K2
SCHEMBL5624185 0.80 MAP2K2 (0.47) MAP2K1MAP2K2
SCHEMBL6533636 0.79 MAP2K1 (0.68) MAP2K1MAP2K2
SCHEMBL6317553 0.79 MAP2K1 (0.61) MAP2K1MAP2K2

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
WO-2005000818-A1 5-SUBSTITUTED-4-`(SUBSTITUTED PHENYL)!AMINO!-2-PYRIDONE DEVIATIVES FOR USE AS MEK INHIBITORS WARNER-LAMBERT COMPANY LLC (US) 2005-01-06 WO disclosed