SCHEMBL5066988

SCHEMBL5066988

Cn1c(=O)c(-c2ccc(F)c(NC(=O)Nc3cc(C(C)(C)C)nn3-c3ccc4[nH]ncc4c3)c2)cc2cnc(N)nc21

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 9/20 0.44
MAPK13 O15264 1/20 0.44
MAPK12 P53778 1/20 0.44
MAPK11 Q15759 1/20 0.44
SYK P43405 7/20 0.43
SRC P12931 7/20 0.43
GSK3A P49840 5/20 0.42
FLT3 P36888 2/20 0.41
TRPV1 Q8NER1 1/20 0.40
NTRK1 P04629 1/20 0.40
NTRK3 Q16288 1/20 0.40
NTRK2 Q16620 1/20 0.40
MAPK9 P45984 1/20 0.40
DDR2 Q16832 1/20 0.40
PTK2 Q05397 2/20 0.40
CYP2D6 P10635 1/20 0.40
BRAF P15056 3/20 0.40

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
SCHEMBL5059875 0.92 RAF1 (0.45) MAPK14MAPK13MAPK12MAPK11SYK
SCHEMBL5065364 0.88 MAPK14 (0.53) MAPK14MAPK13MAPK12MAPK11SRC
SCHEMBL4563409 0.87 MAPK14 (0.53) MAPK14MAPK13MAPK12MAPK11SRC
SCHEMBL4429207 0.87 ABL1 (0.55) MAPK14MAPK13MAPK12MAPK11SYK
SCHEMBL5061595 0.87 MAPK14 (0.46) MAPK14MAPK13MAPK12MAPK11SYK
SCHEMBL5065431 0.85 BRAF (0.46) MAPK14MAPK13MAPK12MAPK11SRC
SCHEMBL5065442 0.84 MAPK14 (0.57) MAPK14MAPK13MAPK12MAPK11SRC
SCHEMBL5067085 0.84 MAPK14 (0.46) MAPK14MAPK13MAPK12MAPK11SRC
SCHEMBL5062510 0.82 KCNJ6 (0.49) MAPK14MAPK13MAPK12MAPK11SRC
SCHEMBL4420251 0.82 BRAF (0.44) MAPK14MAPK13MAPK12MAPK11SRC

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 MAPK14 240/4885MAPK13 156/4885MAPK12 116/4885
US-20080114006-A1 Kinase inhibitors useful for the treatment of proliferative diseases BRAF, PRKDC, RAF1 MAPK14 240/4885MAPK13 156/4885MAPK12 116/4885

“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.