SCHEMBL1640358

SCHEMBL1640358

COc1cccc(N(C(=O)C(F)(F)F)c2cccc(-c3nc(C)sc3-c3ccnc(Nc4ccc5c(c4)CN(C)CC5)n3)c2)c1

nearest known ligand 0.53

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
BRAF P15056 6/20 0.53
CCNA2 P20248 1/20 0.45
CDK2 P24941 1/20 0.45
CCNA1 P78396 1/20 0.45
EGFR P00533 2/20 0.43
ERBB2 P04626 1/20 0.43
IGF1R P08069 1/20 0.43
ACVR1 Q04771 4/20 0.42
SYK P43405 4/20 0.41
MAP3K14 Q99558 2/20 0.41
TYRO3 Q06418 1/20 0.40
MERTK Q12866 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
Trifluoroacetic Acid SCHEMBL1640355 0.84 BRAF (0.61) BRAFCCNA2CDK2CCNA1EGFR
SCHEMBL12766503 0.83 BRAF (0.64) BRAFEGFRERBB2IGF1RSYK
SCHEMBL13815937 0.80 BRAF (0.68) BRAFCDK2EGFRERBB2IGF1R
SCHEMBL1641483 0.80 BRAF (0.54) BRAFCDK2EGFRERBB2IGF1R
SCHEMBL1641799 0.78 BRAF (0.59) BRAFCDK2EGFRERBB2IGF1R
Trifluoroacetic Acid SCHEMBL1641078 0.78 BRAF (0.64) BRAFEGFRERBB2IGF1RACVR1
SCHEMBL1640365 0.78 BRAF (0.64) BRAFEGFRERBB2IGF1RACVR1
SCHEMBL1641784 0.77 BRAF (0.65) BRAFEGFRERBB2IGF1R
SCHEMBL12726671 0.77 BRAF (0.68) BRAFEGFRERBB2IGF1RACVR1
SCHEMBL1640449 0.77 BRAF (0.61) BRAFCCNA2CDK2CCNA1EGFR

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-20110098296-A1 Thiazole And Oxazole Kinase Inhibitors GLAXOSMITHKLINE LLC 2011-04-28 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-20110098296-A1 Thiazole And Oxazole Kinase Inhibitors PDXK, MAP3K1, MAP4K2 BRAF 151/4885CCNA2 1643/4885CDK2 34/4885

“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.