SCHEMBL5066924

SCHEMBL5066924

CCn1c(=O)c(-c2ccc(F)c(NC(=O)Nc3cccc4ccccc34)c2)cc2cnc(N)nc21

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRAF P15056 2/20 0.48
KRAS P01116 1/20 0.48
RAF1 P04049 1/20 0.48
KDR P35968 1/20 0.48
MAP2K2 P36507 1/20 0.48
MAP2K1 Q02750 1/20 0.48
KIT P10721 1/20 0.43
PDGFRA P16234 1/20 0.43
KDM4E B2RXH2 1/20 0.40
MEN1 O00255 1/20 0.40
MAPT P10636 1/20 0.40
RAB9A P51151 1/20 0.40
KMT2A Q03164 1/20 0.40
NTRK1 P04629 1/20 0.39
NTRK3 Q16288 1/20 0.39
FLT1 P17948 1/20 0.39
TEK Q02763 1/20 0.39
FGFR4 P22455 1/20 0.39
EGFR P00533 1/20 0.39
FGFR1 P11362 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
SCHEMBL5065297 0.89 FGFR1 (0.48) BRAFKRASRAF1KDRMAP2K2
SCHEMBL4272148 0.87 KRAS (0.47) BRAFKRASRAF1KDRMAP2K2
SCHEMBL4278999 0.85 LCK (0.53) BRAFKRASRAF1KDRMAP2K2
SCHEMBL4552992 0.84 BRAF (0.47) BRAFKRASRAF1KDRMAP2K2
SCHEMBL4424418 0.84 BRAF (0.47) BRAFKRASRAF1KDRMAP2K2
SCHEMBL5065406 0.84 BRAF (0.68) BRAFKRASRAF1KDRMAP2K2
SCHEMBL5057562 0.84 MAPT (0.47) BRAFKRASRAF1KDRMAP2K2
SCHEMBL4418015 0.82 BRAF (0.50) BRAFKRASRAF1KDRMAP2K2
SCHEMBL4422580 0.82 KCNJ6 (0.48) BRAFKRASRAF1KDRMAP2K2
SCHEMBL4419018 0.82 BRAF (0.54) 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 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 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.