SCHEMBL1640449

SCHEMBL1640449

Cc1nc(-c2cccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c2)c(-c2ccnc(Nc3ccc4c(c3)CN(C)CC4)n2)s1

nearest known ligand 0.61

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
BRAF P15056 12/20 0.61
RAF1 P04049 3/20 0.52
MAPK14 Q16539 1/20 0.51
EGFR P00533 1/20 0.48
ERBB2 P04626 1/20 0.48
IGF1R P08069 1/20 0.48
GSK3B P49841 4/20 0.45
CDK4 P11802 2/20 0.45
CCND3 P30281 2/20 0.45
MAP3K14 Q99558 1/20 0.43
CCNA2 P20248 1/20 0.43
CDK2 P24941 1/20 0.43
CCNA1 P78396 1/20 0.43
PIM1 P11309 1/20 0.43
ACVR1 Q04771 1/20 0.43

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
SCHEMBL13815937 0.87 BRAF (0.68) BRAFEGFRERBB2IGF1RCDK4
SCHEMBL1641784 0.85 BRAF (0.65) BRAFMAPK14EGFRERBB2IGF1R
SCHEMBL12726671 0.82 BRAF (0.68) BRAFEGFRERBB2IGF1RMAP3K14
Trifluoroacetic Acid SCHEMBL1641078 0.81 BRAF (0.64) BRAFEGFRERBB2IGF1RMAP3K14
SCHEMBL12726658 0.81 BRAF (0.63) BRAFEGFRERBB2IGF1RMAP3K14
Trifluoroacetic Acid SCHEMBL1640355 0.81 BRAF (0.61) BRAFEGFRERBB2IGF1RMAP3K14
SCHEMBL1640365 0.80 BRAF (0.64) BRAFMAPK14EGFRERBB2IGF1R
SCHEMBL12766503 0.80 BRAF (0.64) BRAFEGFRERBB2IGF1RMAP3K14
SCHEMBL1641982 0.80 BRAF (0.51) BRAFRAF1MAPK14EGFRGSK3B
SCHEMBL1641799 0.79 BRAF (0.59) BRAFEGFRERBB2IGF1RCDK4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110098296-A1 Thiazole And Oxazole Kinase Inhibitors GLAXOSMITHKLINE LLC 2011-04-28 US disclosed
US-20110098296-A1 Thiazole And Oxazole Kinase Inhibitors GLAXOSMITHKLINE LLC 2011-04-28 US disclosed
US-20110098296-A1 Thiazole And Oxazole Kinase Inhibitors GLAXOSMITHKLINE LLC 2011-04-28 US disclosed
WO-2009076140-A1 THIAZOLE AND OXAZOLE KINASE INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2009-06-18 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-20110098296-A1 Thiazole And Oxazole Kinase Inhibitors PDXK, MAP3K1, MAP4K2 BRAF 151/4885RAF1 331/4885MAPK14 312/4885

“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.