SCHEMBL4860207

SCHEMBL4860207

O=C(O)c1cc(Br)c(F)c(F)c1Nc1ccc(I)cc1F

nearest known ligand 0.70

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAP2K1 Q02750 15/20 0.70
MAP2K2 P36507 9/20 0.70
IDO1 P14902 1/20 0.58
AURKA O14965 4/20 0.54
TNFRSF1A P19438 4/20 0.54
SRC P12931 3/20 0.54
PRKCB P05771 1/20 0.54
STK3 Q13188 1/20 0.54
MAP3K9 P80192 3/20 0.53
KDR P35968 2/20 0.53
ABL1 P00519 2/20 0.49
LCK P06239 2/20 0.49
CLK1 P49759 2/20 0.49
FGFR1 P11362 1/20 0.49
EPHA2 P29317 1/20 0.49
BTK Q06187 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
SCHEMBL5393899 0.88 MAP2K1 (0.66) MAP2K1MAP2K2
SCHEMBL4860159 0.88 MAP2K1 (0.75) MAP2K1MAP2K2IDO1AURKATNFRSF1A
SCHEMBL4856761 0.87 MAP2K1 (0.70) MAP2K1MAP2K2IDO1AURKATNFRSF1A
SCHEMBL2387610 0.87 MAP2K1 (0.53) MAP2K1MAP2K2IDO1AURKATNFRSF1A
SCHEMBL4861840 0.84 MAP2K1 (0.70) MAP2K1MAP2K2IDO1AURKATNFRSF1A
SCHEMBL4859773 0.83 MAP2K1 (0.60) MAP2K1MAP2K2
SCHEMBL188505 0.82 MAP2K1 (1.00) MAP2K1MAP2K2IDO1
SCHEMBL1341919 0.82 KDM4E (0.52) MAP2K1MAP2K2
SCHEMBL29413559 0.82 MAP2K1 (1.00) MAP2K1MAP2K2IDO1
SCHEMBL30505247 0.82 MAP2K1 (1.00) MAP2K1MAP2K2IDO1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1301472-B1 OXYGENATED ESTERS OF 4-IODO PHENYLAMINO BENZHYDROXAMIC ACIDS WARNER LAMBERT CO (US) 2014-03-26 EP disclosed
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

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.