SCHEMBL13225905

SCHEMBL13225905

CB(O)NCc1ccc(Nc2ncc3cc(C#C[Si](C)(C)C)ccc3n2)cc1

nearest known ligand 0.41

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ BRAF P15056 20/20 0.41
▸ RAF1 P04049 1/20 0.34

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
SCHEMBL13225903 0.83 BRAF (0.41) BRAFRAF1
SCHEMBL12671174 0.82 BRAF (0.45) BRAFRAF1
SCHEMBL13225904 0.81 BRAF (0.45) BRAFRAF1
SCHEMBL12671534 0.75 CDK4 (0.39) BRAF
SCHEMBL13225923 0.68 MAP4K1 (0.41) —
SCHEMBL13225922 0.68 MAP4K1 (0.39) —
SCHEMBL1571409 0.67 MAP4K1 (0.42) —
SCHEMBL12671538 0.67 BRAF (0.50) BRAF
SCHEMBL1570948 0.66 BRAF (0.50) BRAF
SCHEMBL12671465 0.66 ALK (0.41) BRAF

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-20100216767-A1 QUINAZOLINES FOR PDK1 INHIBITION AIKAWA MINA 2010-08-26 — — US disclosed
US-20100121052-A1 Novel compounds for treating proliferative diseases JAIN RAMA 2010-05-13 — — 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-20100216767-A1 QUINAZOLINES FOR PDK1 INHIBITION PDK1, PDK2, PDK3 BRAF 316/4885RAF1 143/4885
US-20100121052-A1 Novel compounds for treating proliferative diseases PDK1, PDK2, PDK3 BRAF 208/4885RAF1 215/4885

“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.

Send feedback