SCHEMBL15284340

SCHEMBL15284340

CCOc1cc(F)c(F)c(Nc2ccc(I)cc2F)c1NS(=O)(=O)C1(CC(O)CO)CC1

nearest known ligand 0.84

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAP2K1 Q02750 20/20 0.84
MAP2K2 P36507 6/20 0.84
CHEK1 O14757 1/20 0.84
MAPK10 P53779 1/20 0.84
PRKAG1 P54619 1/20 0.84
ADCK1 Q86TW2 1/20 0.84
PRKAG2 Q9UGJ0 1/20 0.84
MAP2K5 Q13163 2/20 0.44
BRAF P15056 1/20 0.44
MAPK1 P28482 1/20 0.44
CA2 P00918 1/20 0.40

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
SCHEMBL15284338 1.00 MAP2K1 (0.84) MAP2K1MAP2K2CHEK1MAPK10PRKAG1
Refametinib SCHEMBL29360059 0.91 MAP2K1 (1.00) MAP2K1MAP2K2CHEK1MAPK10PRKAG1
Refametinib SCHEMBL29368551 0.91 MAP2K1 (1.00) MAP2K1MAP2K2CHEK1MAPK10PRKAG1
Refametinib SCHEMBL29398471 0.91 MAP2K1 (1.00) MAP2K1MAP2K2CHEK1MAPK10PRKAG1
Refametinib SCHEMBL29358040 0.91 MAP2K1 (1.00) MAP2K1MAP2K2CHEK1MAPK10PRKAG1
Refametinib SCHEMBL10314890 0.91 MAP2K1 (1.00) MAP2K1MAP2K2CHEK1MAPK10PRKAG1
Refametinib SCHEMBL29385439 0.91 MAP2K1 (1.00) MAP2K1MAP2K2CHEK1MAPK10PRKAG1
Refametinib SCHEMBL346872 0.91 MAP2K1 (1.00) MAP2K1MAP2K2CHEK1MAPK10PRKAG1
Refametinib SCHEMBL345334 0.91 MAP2K1 (1.00) MAP2K1MAP2K2CHEK1MAPK10PRKAG1
Refametinib SCHEMBL345333 0.91 MAP2K1 (1.00) MAP2K1MAP2K2CHEK1MAPK10PRKAG1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130261339-A1 Polymorphic Form of N-(S)-(3,4-Difluoro-2-(2-Fluoro-4-Iodophenylamino)-6-Methoxyphenyl)-1-(2,3-Dihydroxypropyl)Cyclopropane-1-Sulfonamide and uses thereof ARDEA BIOSCIENCES, INC. (US) 2013-10-03 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-20130261339-A1 Polymorphic Form of N-(S)-(3,4-Difluoro-2-(2-Fluoro-4-Iodophenylamino)-6-Methoxyphenyl)-1-(2,3-Dihydroxypropyl)Cyclopropane-1-Sulfonamide and uses thereof CYP2S1, CYP2D6, SULT2A1 MAP2K1 4765/4885MAP2K2 4747/4885CHEK1 3724/4885

“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.