SCHEMBL5057367

SCHEMBL5057367

CNc1ncc2cc(-c3ccc(F)c(NC(=O)Nc4cc(C(F)(F)F)ccc4F)c3)c(=O)n(C(C)C)c2n1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDR P35968 10/20 0.47
BRAF P15056 6/20 0.47
RAF1 P04049 4/20 0.47
KRAS P01116 3/20 0.47
RET P07949 3/20 0.45
MAP2K2 P36507 2/20 0.44
MAP2K1 Q02750 2/20 0.44
SIK1 P57059 1/20 0.43
SIK2 Q9H0K1 1/20 0.43
SIK3 Q9Y2K2 1/20 0.43
PDGFRB P09619 4/20 0.42
LCK P06239 4/20 0.42
MAPK14 Q16539 3/20 0.42
JAK3 P52333 2/20 0.42
NTRK1 P04629 2/20 0.41
FLT3 P36888 2/20 0.41
NTRK3 Q16288 2/20 0.41
NTRK2 Q16620 2/20 0.41
LTK P29376 1/20 0.41
CDK8 P49336 1/20 0.41

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
SCHEMBL5065340 0.92 KDR (0.53) KDRBRAFRAF1KRASRET
SCHEMBL4274353 0.89 BRAF (0.55) KDRBRAFRAF1KRASRET
SCHEMBL5067015 0.87 BRAF (0.46) KDRBRAFRAF1KRASMAP2K2
SCHEMBL4276391 0.87 BRAF (0.46) KDRBRAFRAF1KRASMAP2K2
SCHEMBL5062436 0.86 KDR (0.48) KDRBRAFRAF1KRASRET
SCHEMBL4430448 0.86 BRAF (0.44) KDRBRAFRAF1KRASMAP2K2
SCHEMBL5057671 0.85 SIK2 (0.53) KDRBRAFRAF1KRASMAP2K2
SCHEMBL4425996 0.85 KDR (0.57) KDRBRAFRAF1KRASRET
SCHEMBL4279385 0.85 BRAF (0.43) KDRBRAFRAF1KRASMAP2K2
SCHEMBL4429145 0.84 KDR (0.45) KDRBRAFRAF1KRASMAP2K2

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 4 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
US-20080114006-A1 Kinase inhibitors useful for the treatment of proliferative diseases DECIPHERA PARMACEUTICALS, LLC (US) 2008-05-15 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-20120289540-A1 KINASE INHIBITORS USEFUL FOR THE TREATMENT OF PROLIFERATIVE DISEASES BRAF, PRKDC, RAF1 KDR 500/4885BRAF 1/4885RAF1 3/4885
US-20080114006-A1 Kinase inhibitors useful for the treatment of proliferative diseases BRAF, PRKDC, RAF1 KDR 500/4885BRAF 1/4885RAF1 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.