SCHEMBL6700547

SCHEMBL6700547

Cn1c(Nc2cccc(C(C)(C)C)c2)nc2cc(Oc3ccnc(C=NO)c3)ccc21

nearest known ligand 0.69

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
BRAF P15056 20/20 0.69
LCK P06239 4/20 0.69
FYN P06241 4/20 0.69
PDGFRB P09619 4/20 0.69
KIT P10721 4/20 0.69
FLT1 P17948 4/20 0.69
FLT4 P35916 4/20 0.69
KDR P35968 4/20 0.69
SRC P12931 1/20 0.69
RAF1 P04049 6/20 0.68
CYP3A4 P08684 3/20 0.67

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
SCHEMBL6700542 1.00 BRAF (0.69) BRAFLCKFYNPDGFRBKIT
SCHEMBL13559541 1.00 BRAF (0.69) BRAFLCKFYNPDGFRBKIT
SCHEMBL6701432 0.92 BRAF (0.69) BRAFLCKFYNPDGFRBKIT
SCHEMBL6701429 0.92 BRAF (0.69) BRAFLCKFYNPDGFRBKIT
SCHEMBL13559539 0.92 BRAF (0.69) BRAFLCKFYNPDGFRBKIT
SCHEMBL6701141 0.90 BRAF (0.65) BRAFLCKFYNPDGFRBKIT
SCHEMBL6701146 0.90 BRAF (0.65) BRAFLCKFYNPDGFRBKIT
SCHEMBL13559518 0.90 BRAF (0.65) BRAFLCKFYNPDGFRBKIT
SCHEMBL6700934 0.88 BRAF (0.58) BRAFLCKFYNPDGFRBKIT
SCHEMBL13559546 0.88 BRAF (0.58) BRAFLCKFYNPDGFRBKIT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8299108-B2 for treatment of hematological/hormone-dependent cancer NOVARTIS AG (CH) 2012-10-30 US disclosed
US-20040122237-A1 Substituted benzazoles and methods of their use as inhibitors of Raf kinase NOVARTIS AG (CH) 2004-06-24 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-20040122237-A1 Substituted benzazoles and methods of their use as inhibitors of Raf kinase BRAF, RAF1, ARAF BRAF 1/4885LCK 250/4885FYN 667/4885

“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.