SCHEMBL15023916

SCHEMBL15023916

CNC(=O)Cc1cccc(Nc2nccc(CCc3ccccc3N(C)S(C)(=O)=O)n2)c1

nearest known ligand 0.47

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
KDR P35968 10/20 0.47
NEK2 P51955 1/20 0.42
MET P08581 1/20 0.42
ALK Q9UM73 1/20 0.42
PTK2 Q05397 7/20 0.42

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
SCHEMBL10125269 0.91 PTK2 (0.46) KDRNEK2PTK2
SCHEMBL15023917 0.83 KDR (0.45) KDRNEK2METPTK2
SCHEMBL670678 0.81 PTK2 (0.51) METALKPTK2
SCHEMBL670504 0.78 PTK2 (0.57) PTK2
SCHEMBL669539 0.76 SYK (0.58) PTK2
SCHEMBL10125446 0.75 PTK2 (0.42) PTK2
SCHEMBL669272 0.75 POLB (0.48) PTK2
SCHEMBL10125453 0.74 SYK (0.44) PTK2
SCHEMBL669170 0.74 SYK (0.52) PTK2
SCHEMBL670544 0.74 PTK2 (0.63) KDRMETALKPTK2

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
EP-2606034-B1 PYRIMIDINE DERIVATIVE AS FAK INHIBITORS MERCK PATENT GMBH (DE) 2016-03-09 EP claimed
US-8906916-B2 Pyrimidine derivatives as FAK inhibitors MERCK PATENT GMBH (DE) 2014-12-09 US claimed
US-20130158005-A1 PYRIMIDINE DERIVATIVES AS FAK INHIBITORS MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2013-06-20 US claimed
EP-2606034-B1 PYRIMIDINE DERIVATIVE AS FAK INHIBITORS MERCK PATENT GMBH (DE) 2016-03-09 EP 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 (1 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-20130158005-A1 PYRIMIDINE DERIVATIVES AS FAK INHIBITORS CDK2, PTK2, CDKN1A KDR 605/4885NEK2 261/4885MET 1518/4885

“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.