SCHEMBL3589749

SCHEMBL3589749

Cc1nccc(Oc2ccc(NC(=O)c3nc4cc(C(F)(F)F)ccc4[nH]3)cc2)c1C(N)=O

nearest known ligand 0.46

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
BRAF P15056 12/20 0.46
KDR P35968 6/20 0.43
BRD4 O60885 1/20 0.43
MAPK14 Q16539 2/20 0.42
TNNI3K Q59H18 2/20 0.42
RAF1 P04049 2/20 0.40
MET P08581 1/20 0.40
PDGFRA P16234 1/20 0.39

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
SCHEMBL3601549 0.80 KDR (0.54) BRAFKDRBRD4MAPK14TNNI3K
SCHEMBL13408250 0.79 KDR (0.65) BRAFKDRMAPK14TNNI3KRAF1
SCHEMBL3588092 0.76 NPC1 (0.51) BRAFKDRBRD4MAPK14TNNI3K
SCHEMBL3589751 0.72 KDR (0.53) BRAFKDRMAPK14TNNI3KRAF1
SCHEMBL3670190 0.71 HIF1A (0.48) KDRRAF1
SCHEMBL3589289 0.71 BRAF (0.60) BRAFKDRMAPK14TNNI3KRAF1
SCHEMBL12832428 0.70 HRH4 (0.47)
SCHEMBL32680298 0.69 HRH4 (0.44) RAF1
SCHEMBL3596312 0.69 NPC1 (0.50) KDRRAF1
SCHEMBL13408255 0.68 BRAF (0.49) BRAFKDRMAPK14TNNI3KRAF1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1643991-B1 BENZIMIDAZOLE CARBOXAMIDES AS RAF KINASE INHIBITORS MERCK PATENT GMBH (DE) 2014-03-12 EP disclosed
US-7691870-B2 Benzimidazole carboxamides as raf kinase inhibitors MERCK PATENT GMBH (DE) 2010-04-06 US disclosed
US-20070093532-A1 Benzimidazole carboxamides as raf kinase inhibitors MERCK PATENT GMBH (DE) 2007-04-26 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-20070093532-A1 Benzimidazole carboxamides as raf kinase inhibitors BRAF, RAF1, ARAF BRAF 1/4885KDR 843/4885BRD4 84/4885

“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.