SCHEMBL1367889

SCHEMBL1367889

CC(C)(C)Oc1ccc(C(=O)Nc2ccc(Cl)c(C(=O)Nc3cnc4[nH]ccc4c3)c2)cc1

nearest known ligand 0.59

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
BRAF P15056 8/20 0.59
CDK8 P49336 2/20 0.46
KDR P35968 2/20 0.45
TRPV1 Q8NER1 1/20 0.44
KIT P10721 1/20 0.44
CSF1R P07333 1/20 0.43
PPARG P37231 1/20 0.43
PPARA Q07869 1/20 0.43
NR1H4 Q96RI1 1/20 0.43
PRSS12 P56730 1/20 0.43
TNIK Q9UKE5 1/20 0.43
PIK3CA P42336 2/20 0.43
MTOR P42345 2/20 0.43
SCN8A Q9UQD0 1/20 0.43
SCN10A Q9Y5Y9 1/20 0.43

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
SCHEMBL1366577 0.83 BRAF (0.60) BRAFCDK8KDRCSF1RPPARG
SCHEMBL1366044 0.83 BRAF (0.58) BRAFCDK8KDRKITTNIK
SCHEMBL1367284 0.81 BRAF (0.60) BRAFKDRCSF1R
SCHEMBL1366046 0.81 BRAF (0.53) BRAFCDK8KDRKITPIK3CA
SCHEMBL1366062 0.79 BRAF (0.62) BRAFKDRKITPPARGTNIK
SCHEMBL1369057 0.79 BRAF (0.62) BRAFKDRKITTNIKPIK3CA
SCHEMBL1367193 0.79 BRAF (0.56) BRAFKDRKITCSF1RTNIK
SCHEMBL1368499 0.78 BRAF (0.55) BRAFKDRPPARG
SCHEMBL1365186 0.78 BRAF (0.59) BRAFCDK8KDRCSF1RTNIK
SCHEMBL4107604 0.78 BRAF (0.61) BRAFCDK8KDRKITPIK3CA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8067599-B2 Imidazo [4,5-B] pyridine and pyrrolo [2,3-B] pyridine protein kinase inhibitors HOFFMAN-LA ROCHE INC. (US) 2011-11-29 US claimed
US-20090318428-A1 HETEROARYL DERIVATIVES AS PROTEIN KINASE INHIBITORS HOFFMANN-LA ROCHE, INC. 2009-12-24 US claimed
CN-101511828-A Heteroaryl derivatives as protein kinase inhibitors HOFFMANN LA ROCHE (CH) 2009-08-19 CN claimed
US-8067599-B2 Imidazo [4,5-B] pyridine and pyrrolo [2,3-B] pyridine protein kinase inhibitors HOFFMAN-LA ROCHE INC. (US) 2011-11-29 US disclosed
US-20090318428-A1 HETEROARYL DERIVATIVES AS PROTEIN KINASE INHIBITORS HOFFMANN-LA ROCHE, INC. 2009-12-24 US disclosed
CN-101511828-A Heteroaryl derivatives as protein kinase inhibitors HOFFMANN LA ROCHE (CH) 2009-08-19 CN 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-20090318428-A1 HETEROARYL DERIVATIVES AS PROTEIN KINASE INHIBITORS MAP3K5, MAP3K1, PRKACA BRAF 35/4885CDK8 314/4885KDR 1193/4885

“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.