SCHEMBL6529027

SCHEMBL6529027

C=CCn1cc(C(=O)O)c(Nc2ccc(I)cc2F)cc1=O.C=CCn1cc(C(N)=O)c(Nc2ccc(I)cc2F)cc1=O

nearest known ligand 0.92

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
MAP2K1 Q02750 20/20 0.92
MAP2K2 P36507 17/20 0.92

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
SCHEMBL5623393 0.96 MAP2K2 (1.00) MAP2K1MAP2K2
SCHEMBL5623046 0.95 MAP2K1 (0.82) MAP2K1MAP2K2
SCHEMBL6530050 0.87 MAP2K1 (0.82) MAP2K1MAP2K2
SCHEMBL6531256 0.86 MAP2K1 (0.69) MAP2K1MAP2K2
SCHEMBL5622783 0.86 MAP2K2 (0.78) MAP2K1MAP2K2
SCHEMBL6499556 0.85 MAP2K1 (0.92) MAP2K1MAP2K2
SCHEMBL5623022 0.82 MAP2K2 (1.00) MAP2K1MAP2K2
SCHEMBL5622745 0.82 MAP2K1 (0.74) MAP2K1MAP2K2
SCHEMBL5622976 0.81 MAP2K1 (1.00) MAP2K1MAP2K2
SCHEMBL6533927 0.81 MAP2K1 (0.93) 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