SCHEMBL4416124

SCHEMBL4416124

CNc1cc2c(cn1)cc(-c1cc(NC(=O)Nc3nnc(C(C)(C)C)s3)c(F)cc1Cl)c(=O)n2C

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
RAF1 P04049 10/20 0.48
BRAF P15056 9/20 0.48
KRAS P01116 6/20 0.48
KDR P35968 6/20 0.48
MAP2K2 P36507 5/20 0.48
MAP2K1 Q02750 5/20 0.48
KIT P10721 1/20 0.45
PDGFRA P16234 1/20 0.45
FGFR1 P11362 5/20 0.45
SRC P12931 4/20 0.45
ARAF P10398 1/20 0.39
RAB9A P51151 2/20 0.38
NPC1 O15118 1/20 0.38
NEK7 Q8TDX7 1/20 0.38
ALDH1A1 P00352 1/20 0.35

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
SCHEMBL5065300 0.86 BRAF (0.59) RAF1BRAFKRASKDRKIT
SCHEMBL22538096 0.84 FGFR1 (0.55) RAF1BRAFKRASKDRMAP2K2
SCHEMBL4552611 0.83 RAF1 (0.54) RAF1BRAFKRASKDRMAP2K2
SCHEMBL5057397 0.83 BRAF (0.48) RAF1BRAFKRASKDRMAP2K2
SCHEMBL5065438 0.83 BRAF (0.48) RAF1BRAFKRASKDRMAP2K2
SCHEMBL4424981 0.83 BRAF (0.61) RAF1BRAFKRASKDRMAP2K2
SCHEMBL5057420 0.82 BRAF (0.72) RAF1BRAFKRASKDRMAP2K2
SCHEMBL4427156 0.82 BRAF (0.49) RAF1BRAFKRASKDRMAP2K2
SCHEMBL5061696 0.82 BRAF (0.47) RAF1BRAFKRASKDRMAP2K2
SCHEMBL4425085 0.81 BRAF (0.63) RAF1BRAFKRASKDRMAP2K2

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 RAF1 3/4885BRAF 1/4885KRAS 30/4885
US-20080114006-A1 Kinase inhibitors useful for the treatment of proliferative diseases BRAF, PRKDC, RAF1 RAF1 3/4885BRAF 1/4885KRAS 30/4885

“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.