SCHEMBL7051635

SCHEMBL7051635

Cc1cc(I)ccc1Nc1cc(F)ccc1C(=O)NOCCCO.Cc1cc(I)ccc1Nc1cc(F)ccc1C(=O)NOCCO

nearest known ligand 0.69

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MAP2K1 Q02750 19/20 0.69
MAP2K2 P36507 3/20 0.55
MAP2K5 Q13163 1/20 0.53
EIF2AK1 Q9BQI3 1/20 0.53
KCNH2 Q12809 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
SCHEMBL4856709 0.99 MAP2K1 (0.67) MAP2K1MAP2K2MAP2K5EIF2AK1KCNH2
SCHEMBL4857251 0.96 MAP2K1 (0.74) MAP2K1MAP2K2MAP2K5EIF2AK1KCNH2
SCHEMBL4863269 0.89 MAP2K1 (0.72) MAP2K1MAP2K2
SCHEMBL4860649 0.89 MAP2K1 (0.64) MAP2K1MAP2K2MAP2K5EIF2AK1KCNH2
SCHEMBL6229824 0.89 MAP2K1 (0.64) MAP2K1MAP2K2MAP2K5EIF2AK1KCNH2
SCHEMBL4864015 0.88 MAP2K1 (0.60) MAP2K1MAP2K2MAP2K5EIF2AK1
SCHEMBL4862843 0.87 MAP2K1 (0.58) MAP2K1MAP2K2
SCHEMBL26047715 0.86 MAP2K1 (0.76) MAP2K1MAP2K2MAP2K5EIF2AK1KCNH2
SCHEMBL4863225 0.86 MAP2K1 (0.61) MAP2K1MAP2K2MAP2K5EIF2AK1KCNH2
SCHEMBL4861927 0.86 MAP2K1 (0.61) MAP2K1MAP2K2MAP2K5EIF2AK1KCNH2

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
EP-1301472-A2 OXYGENATED ESTERS OF 4-IODO PHENYLAMINO BENZHYDROXAMIC ACIDS WARNER-LAMBERT COMPANY (US) 2003-04-16 EP disclosed
WO-2002006213-A2 OXYGENATED ESTERS OF 4-IODO PHENYLAMINO BENZHYDROXAMIC ACIDS WARNER-LAMBERT COMPANY (US) 2002-01-24 WO disclosed