SCHEMBL9989084

SCHEMBL9989084

CN(C)c1nc(-c2ccc(F)c(NS(=O)(=O)c3c(F)cccc3F)c2)c(-c2ccnc(Cl)n2)s1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRAF P15056 16/20 0.55
LCK P06239 2/20 0.48
LYN P07948 2/20 0.48
TGFBR1 P36897 2/20 0.48
BTK Q06187 1/20 0.48
ACVR2B Q13705 1/20 0.48
ERBB4 Q15303 1/20 0.48
NCOA1 Q15788 1/20 0.48
RIPK2 O43353 2/20 0.44
NR1I2 O75469 2/20 0.44
PLK4 O00444 1/20 0.44
EPHB6 O15197 1/20 0.44
JAK2 O60674 1/20 0.44
ULK1 O75385 1/20 0.44
ERN1 O75460 1/20 0.44
PRKD3 O94806 1/20 0.44
ABL1 P00519 1/20 0.44
KRAS P01116 1/20 0.44
RAF1 P04049 1/20 0.44
FYN P06241 1/20 0.44

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
SCHEMBL2193407 0.89 BRAF (0.61) BRAFLCKLYNTGFBR1BTK
SCHEMBL2194551 0.86 BRAF (0.72) BRAFLCKLYNTGFBR1BTK
SCHEMBL1727977 0.86 BRAF (0.72) BRAFLCKLYNTGFBR1BTK
SCHEMBL9988900 0.82 BRAF (0.51) BRAFLCKLYNTGFBR1BTK
SCHEMBL2194898 0.78 BRAF (0.75) BRAFLCKLYNTGFBR1RIPK2
SCHEMBL13189769 0.78 BRAF (0.61) BRAFLCKLYNTGFBR1BTK
SCHEMBL17570249 0.77 BRAF (0.52) BRAFLCKLYNTGFBR1RIPK2
SCHEMBL9989042 0.77 BRAF (0.81) BRAFLCKLYNTGFBR1BTK
SCHEMBL9989012 0.77 BRAF (0.64) BRAFLCKLYNTGFBR1BTK
SCHEMBL12058868 0.77 BRAF (0.69) BRAFLCKLYNTGFBR1BTK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110319392-A1 Thiazole Sulfonamide And Oxazole Sulfonamide Kinase Inhibitors GLAXOSMITHKLINE LLC 2011-12-29 US disclosed
US-20110319392-A1 Thiazole Sulfonamide And Oxazole Sulfonamide Kinase Inhibitors GLAXOSMITHKLINE LLC 2011-12-29 US disclosed
WO-2010104899-A1 THIAZOLE SULFONAMIDE AND OXAZOLE SULFONAMIDE KINASE INHIBITORS GLAXOSMITHKLINE LLC (US) 2010-09-16 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-20110319392-A1 Thiazole Sulfonamide And Oxazole Sulfonamide Kinase Inhibitors STK24, MAP3K5, MAP3K2 BRAF 76/4885LCK 49/4885LYN 159/4885

“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.