SCHEMBL1882268

SCHEMBL1882268

CCCS(=O)(=O)Nc1cccc(C(=O)Cc2ccnc(Cl)n2)c1Cl

nearest known ligand 0.41

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
BRAF P15056 13/20 0.41
KCNA5 P22460 1/20 0.39
CTPS1 P17812 1/20 0.38
ADRA1A P35348 1/20 0.37
KCNK3 O14649 1/20 0.37
CYP2C9 P11712 1/20 0.35
PTGS1 P23219 1/20 0.35
PTGS2 P35354 1/20 0.35

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
SCHEMBL1873673 0.90 BRAF (0.49) BRAFCYP2C9
SCHEMBL1871902 0.87 PTGS1 (0.38) BRAFPTGS1PTGS2
SCHEMBL26089296 0.81 BRAF (0.46) BRAF
SCHEMBL3882959 0.79 GAA (0.37)
SCHEMBL1868409 0.79 BRAF (0.41) BRAFKCNA5ADRA1AKCNK3CYP2C9
SCHEMBL1876513 0.78 BRAF (0.39) BRAFCYP2C9PTGS1PTGS2
SCHEMBL12669237 0.78 BRAF (0.51) BRAFCYP2C9
SCHEMBL9987523 0.76 BRAF (0.48) BRAFKCNA5KCNK3CYP2C9
SCHEMBL24761235 0.76 ERCC5 (0.47) CYP2C9
SCHEMBL29751913 0.76 ERCC5 (0.47) CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2585454-A1 HETEROARYL COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS Novartis AG (CH) 2013-05-01 EP disclosed
US-20130096149-A1 HETEROARYL COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS NOVARTIS AG (CH) 2013-04-18 US disclosed
EP-2498608-A1 BENZENE SULFONAMIDE THIAZOLE AND OXAZOLE COMPOUNDS GlaxoSmithKline LLC (US) 2012-09-19 EP disclosed
WO-2011161216-A1 HETEROARYL COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS NOVARTIS AG (CH) 2011-12-29 WO disclosed
WO-2011059610-A1 BENZENE SULFONAMIDE THIAZOLE AND OXAZOLE COMPOUNDS GLAXOSMITHKLINE LLC (US) 2011-05-19 WO disclosed
WO-2011059610-A1 BENZENE SULFONAMIDE THIAZOLE AND OXAZOLE COMPOUNDS GLAXOSMITHKLINE LLC (US) 2011-05-19 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-20130096149-A1 HETEROARYL COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS BRAF, RAF1, ARAF BRAF 1/4885KCNA5 2628/4885CTPS1 2963/4885

“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.