SCHEMBL6912484

SCHEMBL6912484

CNS(=O)(=O)c1cc(Nc2ncnc3cc(OC)c(OC)cc23)c(N(C)C)cc1F

nearest known ligand 0.71

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
BRAF P15056 7/20 0.71
TNNI3K Q59H18 7/20 0.71
KDR P35968 9/20 0.54
FLT1 P17948 5/20 0.54
EGFR P00533 3/20 0.53
FGFR1 P11362 3/20 0.53
RET P07949 7/20 0.53
KIF5B P33176 6/20 0.53
EPHB2 P29323 1/20 0.52
FLT4 P35916 1/20 0.52

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
Hydrochloric Acid SCHEMBL12003561 0.99 BRAF (0.69) BRAFTNNI3KKDRFLT1EGFR
SCHEMBL6911482 0.91 KDR (0.60) BRAFTNNI3KKDRFLT1EGFR
Hydrochloric Acid SCHEMBL12003797 0.90 EGFR (0.60) BRAFTNNI3KKDRFLT1EGFR
SCHEMBL6910970 0.83 BRAF (0.72) BRAFTNNI3KEGFR
SCHEMBL6912268 0.83 BRAF (0.72) BRAFTNNI3KKDRFLT1EGFR
SCHEMBL12003690 0.83 TNNI3K (1.00) BRAFTNNI3K
SCHEMBL30104222 0.83 TNNI3K (1.00) BRAFTNNI3K
Hydrochloric Acid SCHEMBL12003805 0.83 BRAF (0.71) BRAFTNNI3KKDRFLT1EGFR
Hydrochloric Acid SCHEMBL12004112 0.83 BRAF (0.71) BRAFTNNI3KEGFR
Hydrochloric Acid SCHEMBL12003556 0.82 TNNI3K (0.98) BRAFTNNI3K

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8859571-B2 Quinazoline compounds GLAXOSMITHKLINE LLC (US) 2014-10-14 US claimed
EP-2501233-B1 QUINAZOLINE COMPOUNDS GLAXOSMITHKLINE LLC (US) 2014-09-24 EP claimed
US-20120220588-A1 QUINAZOLINE COMPOUNDS GLAXOSMITHKLINE LLC 2012-08-30 US claimed
US-8859571-B2 Quinazoline compounds GLAXOSMITHKLINE LLC (US) 2014-10-14 US disclosed
US-8859571-B2 Quinazoline compounds GLAXOSMITHKLINE LLC (US) 2014-10-14 US disclosed
EP-2501233-B1 QUINAZOLINE COMPOUNDS GLAXOSMITHKLINE LLC (US) 2014-09-24 EP disclosed
EP-2501233-B1 QUINAZOLINE COMPOUNDS GLAXOSMITHKLINE LLC (US) 2014-09-24 EP disclosed
US-20120220588-A1 QUINAZOLINE COMPOUNDS GLAXOSMITHKLINE LLC 2012-08-30 US disclosed
US-20120220588-A1 QUINAZOLINE COMPOUNDS GLAXOSMITHKLINE LLC 2012-08-30 US disclosed
WO-2011056740-A1 QUINAZOLINE COMPOUNDS GLAXOSMITHKLINE LLC (US) 2011-05-12 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-20120220588-A1 QUINAZOLINE COMPOUNDS NQO2, PRMT7, QDPR BRAF 1665/4885TNNI3K 532/4885KDR 2042/4885

“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.