SCHEMBL7159175

SCHEMBL7159175

CC(C)(O)CCONC(=O)c1ccc(F)cc1Nc1ccc(I)cc1F.CC(O)CCONC(=O)c1ccc(F)cc1Nc1ccc(I)cc1F

nearest known ligand 0.53

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAP2K1 Q02750 19/20 0.53
MAP2K2 P36507 5/20 0.51
PIM1 P11309 1/20 0.48
CAMK2B Q13554 1/20 0.48
CYP3A4 P08684 1/20 0.46
CYP2C9 P11712 1/20 0.46
CYP2C19 P33261 1/20 0.46
MAP2K5 Q13163 2/20 0.45
EIF2AK1 Q9BQI3 1/20 0.45
BRAF P15056 1/20 0.45
MAPK1 P28482 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
SCHEMBL4858026 0.93 MAP2K1 (0.60) MAP2K1MAP2K2PIM1CAMK2BMAP2K5
SCHEMBL4859846 0.93 MAP2K1 (0.60) MAP2K1MAP2K2PIM1CAMK2BCYP3A4
SCHEMBL7047956 0.91 MAP2K1 (0.43) MAP2K1MAP2K2PIM1CAMK2BCYP3A4
SCHEMBL7052404 0.90 MAP2K1 (0.49) MAP2K1MAP2K2PIM1CAMK2BCYP3A4
SCHEMBL7050032 0.88 MAP2K1 (0.47) MAP2K1MAP2K2PIM1CAMK2BMAP2K5
SCHEMBL4863738 0.85 MAP2K1 (0.62) MAP2K1MAP2K2PIM1CAMK2BMAP2K5
SCHEMBL4860711 0.84 MAP2K1 (0.60) MAP2K1MAP2K2PIM1CAMK2BCYP3A4
SCHEMBL4863465 0.84 MAP2K1 (0.60) MAP2K1MAP2K2PIM1CAMK2BMAP2K5
SCHEMBL6295247 0.84 MAP2K1 (0.47) MAP2K1MAP2K2PIM1CAMK2BMAP2K5
SCHEMBL4858354 0.83 MAP2K1 (0.48) MAP2K1MAP2K2PIM1CAMK2BCYP3A4

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