SCHEMBL2035689

SCHEMBL2035689

COCCOP(=O)(Cc1ccc(Nc2ncc(C(F)(F)F)c(Cl)n2)cc1)OCCOC

nearest known ligand 0.44

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PTK2 Q05397 14/20 0.44
CDK1 P06493 2/20 0.43
CDK2 P24941 2/20 0.43
KDR P35968 1/20 0.43
BTK Q06187 2/20 0.42
ULK1 O75385 1/20 0.41
STK17A Q9UEE5 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
SCHEMBL2031827 0.90 PTK2 (0.53) PTK2CDK1CDK2BTKSTK17A
SCHEMBL2033998 0.89 PTK2 (0.44) PTK2CDK1CDK2KDRBTK
SCHEMBL2031014 0.85 LRRK2 (0.49) PTK2
SCHEMBL2032400 0.84 PTK2 (0.45) PTK2CDK1CDK2KDRBTK
SCHEMBL2637209 0.82 PTK2 (0.52) PTK2KDRSTK17A
SCHEMBL2035700 0.82 PTK2 (0.44) PTK2CDK1CDK2KDRBTK
SCHEMBL2637214 0.82 PTK2 (0.49) PTK2KDRSTK17A
SCHEMBL2637155 0.80 PTK2 (0.48) PTK2KDRSTK17A
SCHEMBL2030965 0.78 PTK2 (0.65) PTK2KDR
SCHEMBL15226739 0.77 PTK2 (0.44) PTK2CDK1CDK2KDRULK1

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-9096624-B2 Amino pyrimidine anticancer compounds OSI Pharmaceuticals, LLC (US) 2015-08-04 US disclosed
US-20130231306-A1 AMINO PYRIMIDINE ANTICANCER COMPOUNDS OSI Pharmaceuticals, LLC (US) 2013-09-05 US disclosed
US-8399433-B2 Amino pyrimidine anticancer compounds OSI Pharmaceuticals, LLC (US) 2013-03-19 US disclosed
EP-2438056-A2 AMINO PYRIMIDINE ANTICANCER COMPOUNDS OSI Pharmaceuticals, LLC (US) 2012-04-11 EP disclosed
US-20110136764-A1 AMINO PYRIMIDINE ANTICANCER COMPOUNDS OSI PHARMACEUTICALS, INC. (US) 2011-06-09 US disclosed
WO-2010141406-A2 AMINO PYRIMIDINE ANTICANCER COMPOUNDS OSI PHARMACEUTICALS, INC. (US) 2010-12-09 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-20130231306-A1 AMINO PYRIMIDINE ANTICANCER COMPOUNDS DPYD, PTK2, TYMS PTK2 2/4885CDK1 21/4885CDK2 5/4885
US-20110136764-A1 AMINO PYRIMIDINE ANTICANCER COMPOUNDS DPYD, PTK2, TYMS PTK2 2/4885CDK1 21/4885CDK2 5/4885

“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.