SCHEMBL1876508

SCHEMBL1876508

Cc1c(Nc2ccc(I)cc2F)c(NS(=O)(=O)C2CC2CO)c2n(c1=O)CCO2

nearest known ligand 0.42

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MAP2K1 Q02750 20/20 0.42
MAP2K2 P36507 4/20 0.34
MAP2K5 Q13163 1/20 0.34
EIF2AK1 Q9BQI3 1/20 0.34
CHEK1 O14757 1/20 0.34
MAPK10 P53779 1/20 0.34
PRKAG1 P54619 1/20 0.34
ADCK1 Q86TW2 1/20 0.34
PRKAG2 Q9UGJ0 1/20 0.34

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
SCHEMBL1869619 0.86 MAP2K1 (0.43) MAP2K1MAP2K2
SCHEMBL1868069 0.86 MAP2K1 (0.41) MAP2K1MAP2K2
SCHEMBL1869645 0.86 MAP2K1 (0.37) MAP2K1
SCHEMBL1868120 0.86 MAP2K1 (0.41) MAP2K1MAP2K2
SCHEMBL1868918 0.85 MAP2K1 (0.41) MAP2K1MAP2K2MAP2K5CHEK1MAPK10
SCHEMBL1869320 0.84 MAP2K1 (0.42) MAP2K1MAP2K2MAP2K5EIF2AK1CHEK1
SCHEMBL1869049 0.83 MAP2K1 (0.46) MAP2K1MAP2K2MAP2K5EIF2AK1CHEK1
SCHEMBL1868346 0.82 MAP2K1 (0.45) MAP2K1MAP2K2MAP2K5EIF2AK1CHEK1
SCHEMBL1872689 0.81 MAP2K1 (0.43) MAP2K1MAP2K2MAP2K5CHEK1MAPK10
SCHEMBL1865131 0.80 MAP2K1 (0.43) MAP2K1MAP2K2MAP2K5EIF2AK1CHEK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110190334-A1 Heterocyclic Sulfonamide Derivatives NOVARTIS AG (CH) 2011-08-04 US claimed
WO-2011054828-A1 HETEROCYCLIC SULFONAMIDE DERIVATIVES USEFUL AS MEK INHIBITORS NOVARTIS AG (CH) 2011-05-12 WO claimed
US-8466289-B2 Heterocyclic sulfonamide derivatives NOVARTIS AG (CH) 2013-06-18 US disclosed
US-8466289-B2 Heterocyclic sulfonamide derivatives NOVARTIS AG (CH) 2013-06-18 US disclosed
US-20110190334-A1 Heterocyclic Sulfonamide Derivatives NOVARTIS AG (CH) 2011-08-04 US disclosed
US-20110190334-A1 Heterocyclic Sulfonamide Derivatives NOVARTIS AG (CH) 2011-08-04 US disclosed
US-20110190334-A1 Heterocyclic Sulfonamide Derivatives NOVARTIS AG (CH) 2011-08-04 US disclosed
WO-2011054828-A1 HETEROCYCLIC SULFONAMIDE DERIVATIVES USEFUL AS MEK INHIBITORS NOVARTIS AG (CH) 2011-05-12 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-20110190334-A1 Heterocyclic Sulfonamide Derivatives BRAF, KSR2, NRAS MAP2K1 269/4885MAP2K2 184/4885MAP2K5 195/4885

“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.