SCHEMBL2891097

SCHEMBL2891097

CN(C=O)c1cc(Oc2ccc3c(c2)nc(Nc2ccccc2F)n3C)ccn1

nearest known ligand 0.51

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
BRAF P15056 18/20 0.51
RAF1 P04049 9/20 0.51
CYP3A4 P08684 3/20 0.46
LCK P06239 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
SCHEMBL2892832 0.90 BRAF (0.47) BRAFRAF1CYP3A4LCK
SCHEMBL2893887 0.90 BRAF (0.53) BRAFRAF1CYP3A4LCK
SCHEMBL2892968 0.88 NPC1 (0.51) BRAFRAF1LCK
SCHEMBL2887189 0.88 BRAF (0.51) BRAFRAF1LCK
SCHEMBL2893883 0.87 BRAF (0.68) BRAFRAF1CYP3A4LCK
SCHEMBL2892919 0.85 BRAF (0.52) BRAFRAF1
SCHEMBL2891886 0.85 BRAF (0.51) BRAFRAF1LCK
SCHEMBL2895495 0.85 BRAF (0.53) BRAFRAF1CYP3A4LCK
SCHEMBL2894239 0.83 BRAF (0.47) BRAFRAF1LCK
SCHEMBL2893492 0.83 BRAF (0.51) BRAFRAF1

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-20120288501-A1 SUBSTITUTED BENZAZOLES AND METHODS OF THEIR USE AS INHIBITORS OF RAF KINASE NOVARTIS VACCINES AND DIAGNOSTICS, INC. FORMERLY KNOWN AS CHIRON CORPORATION (US) 2012-11-15 US disclosed
US-7728010-B2 Substituted benz-azoles and methods of their use as inhibitors of Raf kinase NOVARTIS VACCINES AND DIAGNOSTICS, INC. (US) 2010-06-01 US disclosed
US-20070299039-A1 Substituted benz-azoles and methods of their use as inhibitors of Raf kinase CHIRON CORPORATION (US) 2007-12-27 US disclosed
US-7071216-B2 Substituted benz-azoles and methods of their use as inhibitors of Raf kinase CHIRON CORPORATION (US) 2006-07-04 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 (2 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-20120288501-A1 SUBSTITUTED BENZAZOLES AND METHODS OF THEIR USE AS INHIBITORS OF RAF KINASE BRAF, RAF1, ARAF BRAF 1/4885RAF1 2/4885CYP3A4 1457/4885
US-20070299039-A1 Substituted benz-azoles and methods of their use as inhibitors of Raf kinase BRAF, RAF1, ARAF BRAF 1/4885RAF1 2/4885CYP3A4 1382/4885

“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.