SCHEMBL4430449

SCHEMBL4430449

CNc1cc2c(cn1)cc(-c1ccc(F)c(NC(=O)Nc3cc(C(C)(C)C)nn3-c3ccccc3)c1)c(=O)n2C

nearest known ligand 0.58

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
BRAF P15056 6/20 0.58
KRAS P01116 2/20 0.58
RAF1 P04049 2/20 0.58
KDR P35968 2/20 0.58
MAP2K2 P36507 2/20 0.58
MAP2K1 Q02750 2/20 0.58
MAPK14 Q16539 12/20 0.52
MAPK13 O15264 11/20 0.52
MAPK12 P53778 11/20 0.52
MAPK11 Q15759 11/20 0.52
DDR2 Q16832 1/20 0.45
KIT P10721 1/20 0.45
PDGFRA P16234 1/20 0.45
NTRK1 P04629 1/20 0.45
NTRK3 Q16288 1/20 0.45
NTRK2 Q16620 1/20 0.45

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
SCHEMBL4566548 0.94 BRAF (0.53) BRAFKRASRAF1KDRMAP2K2
SCHEMBL5057547 0.90 BRAF (0.61) BRAFKRASRAF1KDRMAP2K2
SCHEMBL4566603 0.89 BRAF (0.52) BRAFKRASRAF1KDRMAP2K2
SCHEMBL4425259 0.87 MAPK14 (0.52) BRAFKRASRAF1KDRMAP2K2
SCHEMBL5065364 0.85 MAPK14 (0.53) BRAFMAPK14MAPK13MAPK12MAPK11
SCHEMBL4274846 0.83 BRAF (0.75) BRAFKRASRAF1KDRMAP2K2
SCHEMBL5062493 0.82 BRAF (0.56) BRAFKRASRAF1KDRMAP2K2
SCHEMBL4423915 0.81 BRAF (0.60) BRAFKRASRAF1KDRMAP2K2
SCHEMBL4566804 0.81 BRAF (0.82) BRAFKRASRAF1KDRMAP2K2
SCHEMBL5060109 0.81 MAPK14 (0.50) BRAFKRASRAF1KDRMAP2K2

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-20080114006-A1 Kinase inhibitors useful for the treatment of proliferative diseases DECIPHERA PARMACEUTICALS, LLC (US) 2008-05-15 US claimed
US-20120289540-A1 KINASE INHIBITORS USEFUL FOR THE TREATMENT OF PROLIFERATIVE DISEASES DECIPHERA PHARMACEUTICALS, LLC (US) 2012-11-15 US disclosed
US-8188113-B2 For example, 1-(5-(2-amino-8-methyl-7-oxo-7,8-dihydropyrido[2,3-d]pyrimidin-6-yl)-2-fluorophenyl)-3-(3-tert-butyl-1-phenyl-1H-pyrazol-5-yl)urea; for treatment of mammalian cancers and inflammatory diseases including rheumatoid arthritis, retinopathies DECIPHERA PHARMACEUTICALS, INC. (US) 2012-05-29 US disclosed
EP-2063897-A2 KINASE INHIBITORS USEFUL FOR THE TREATMENT OF PROLIFERATIVE DISEASES Deciphera Pharmaceuticals, LLC. (US) 2009-06-03 EP disclosed
US-20080114006-A1 Kinase inhibitors useful for the treatment of proliferative diseases DECIPHERA PARMACEUTICALS, LLC (US) 2008-05-15 US disclosed
WO-2008034008-A2 KINASE INHIBITORS USEFUL FOR THE TREATMENT OF PROLIFERATIVE DISEASES DECIPHERA PHARMACEUTICALS, LLC. (US) 2008-03-20 WO 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-20120289540-A1 KINASE INHIBITORS USEFUL FOR THE TREATMENT OF PROLIFERATIVE DISEASES BRAF, PRKDC, RAF1 BRAF 1/4885KRAS 30/4885RAF1 3/4885
US-20080114006-A1 Kinase inhibitors useful for the treatment of proliferative diseases BRAF, PRKDC, RAF1 BRAF 1/4885KRAS 30/4885RAF1 3/4885

“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.