SCHEMBL4853099

SCHEMBL4853099

O=C(O)c1cc(F)c(F)c(F)c1Nc1ccc(I)cc1Cl

nearest known ligand 0.77

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAP2K1 Q02750 12/20 0.77
MAP2K2 P36507 7/20 0.59
IDO1 P14902 1/20 0.52
RAF1 P04049 1/20 0.51
PDGFRB P09619 1/20 0.51
CSNK2A2 P19784 1/20 0.51
CSNK2B P67870 1/20 0.51
CSNK2A1 P68400 1/20 0.51
CSNK2A3 Q8NEV1 1/20 0.51
AURKC Q9UQB9 1/20 0.51
CAMK2A Q9UQM7 1/20 0.51
AURKA O14965 4/20 0.47
TNFRSF1A P19438 4/20 0.47
SRC P12931 3/20 0.47
PRKCB P05771 1/20 0.47
STK3 Q13188 1/20 0.47
MAP3K9 P80192 3/20 0.46
KDR P35968 2/20 0.46
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46

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
SCHEMBL4861572 0.91 MAP2K1 (0.74) MAP2K1MAP2K2IDO1RAF1PDGFRB
SCHEMBL4860159 0.88 MAP2K1 (0.75) MAP2K1MAP2K2IDO1AURKATNFRSF1A
SCHEMBL5396163 0.87 MAP2K1 (0.62) MAP2K1MAP2K2RAF1PDGFRBCSNK2A2
SCHEMBL4856761 0.87 MAP2K1 (0.70) MAP2K1MAP2K2IDO1RAF1PDGFRB
Zapnometinib SCHEMBL29362260 0.87 MAP2K1 (1.00) MAP2K1MAP2K2IDO1RAF1PDGFRB
Zapnometinib SCHEMBL30298104 0.87 MAP2K1 (1.00) MAP2K1MAP2K2IDO1RAF1PDGFRB
Zapnometinib SCHEMBL1488782 0.87 MAP2K1 (1.00) MAP2K1MAP2K2IDO1RAF1PDGFRB
SCHEMBL6945694 0.86 MAP2K1 (0.67) MAP2K1MAP2K2IDO1RAF1PDGFRB
SCHEMBL23673886 0.85 MAP2K1 (0.67) MAP2K1MAP2K2IDO1RAF1PDGFRB
SCHEMBL29425507 0.85 MAP2K1 (0.67) MAP2K1MAP2K2IDO1RAF1PDGFRB

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 11 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-2003504400-A 2003-02-04 JP claimed
EP-1202726-A2 METHOD FOR TREATING CHRONIC PAIN USING MEK INHIBITORS WARNER-LAMBERT COMPANY LLC (US) 2002-05-08 EP claimed
WO-2001005392-A2 METHOD FOR TREATING CHRONIC PAIN USING MEK INHIBITORS WARNER-LAMBERT COMPANY (US) 2001-01-25 WO claimed
EP-1301472-B1 OXYGENATED ESTERS OF 4-IODO PHENYLAMINO BENZHYDROXAMIC ACIDS WARNER LAMBERT CO (US) 2014-03-26 EP disclosed
US-7411001-B2 Oxygenated esters of 4-iodo phenylamino benzhydroxamic acids WARNER-LAMBERT COMPANY (US) 2008-08-12 US disclosed
US-7411001-B2 Oxygenated esters of 4-iodo phenylamino benzhydroxamic acids WARNER-LAMBERT COMPANY (US) 2008-08-12 US disclosed
US-7411001-B2 Oxygenated esters of 4-iodo phenylamino benzhydroxamic acids WARNER-LAMBERT COMPANY (US) 2008-08-12 US disclosed
US-6960614-B2 Oxygenated esters of 4-lodo phenylamino benzhydroxamic acids WARNER-LAMBERT COMPANY (US) 2005-11-01 US disclosed
US-20050176820-A1 Oxygenated esters of 4-iodo phenylamino benzhydroxamic acids WARNER-LAMBERT COMPANY 2005-08-11 US disclosed
EP-1202726-A2 METHOD FOR TREATING CHRONIC PAIN USING MEK INHIBITORS WARNER-LAMBERT COMPANY LLC (US) 2002-05-08 EP disclosed
WO-2001005392-A2 METHOD FOR TREATING CHRONIC PAIN USING MEK INHIBITORS WARNER-LAMBERT COMPANY (US) 2001-01-25 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20050176820-A1 Oxygenated esters of 4-iodo phenylamino benzhydroxamic acids CYP4X1, CYP2A7, CYP4B1 MAP2K1 4341/4885MAP2K2 4268/4885IDO1 426/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.