SCHEMBL2035700

SCHEMBL2035700

CCOP(=O)(CC)Cc1ccc(Nc2ncc(C(F)(F)F)c(Cl)n2)cc1

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PTK2 Q05397 13/20 0.44
CCNT1 O60563 3/20 0.42
CDK9 P50750 3/20 0.42
BTK Q06187 2/20 0.42
CDK1 P06493 1/20 0.40
CDK2 P24941 1/20 0.40
STK17A Q9UEE5 1/20 0.39
JAK2 O60674 1/20 0.39
NTRK1 P04629 1/20 0.39
TYK2 P29597 1/20 0.39
KDR P35968 1/20 0.39
JAK3 P52333 1/20 0.39
PTK2B Q14289 1/20 0.39
NTRK3 Q16288 1/20 0.39
NTRK2 Q16620 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) PTK2CCNT1CDK9BTKCDK1
SCHEMBL2032400 0.89 PTK2 (0.45) PTK2BTKCDK1CDK2STK17A
SCHEMBL2637155 0.84 PTK2 (0.48) PTK2STK17AJAK2NTRK1TYK2
SCHEMBL15284677 0.84 LRRK2 (0.47) PTK2
SCHEMBL2033998 0.82 PTK2 (0.44) PTK2BTKCDK1CDK2STK17A
SCHEMBL2637209 0.82 PTK2 (0.52) PTK2STK17AJAK2NTRK1TYK2
SCHEMBL2035689 0.82 PTK2 (0.44) PTK2BTKCDK1CDK2STK17A
SCHEMBL2637214 0.82 PTK2 (0.49) PTK2STK17AJAK2NTRK1TYK2
SCHEMBL2032402 0.78 PTK2 (0.47) PTK2STK17AJAK2NTRK1TYK2
SCHEMBL2035699 0.78 PTK2 (0.46) PTK2CDK1CDK2STK17AJAK2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8399433-B2 Amino pyrimidine anticancer compounds OSI Pharmaceuticals, LLC (US) 2013-03-19 US disclosed
US-20110136764-A1 AMINO PYRIMIDINE ANTICANCER COMPOUNDS OSI PHARMACEUTICALS, INC. (US) 2011-06-09 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 (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-20110136764-A1 AMINO PYRIMIDINE ANTICANCER COMPOUNDS DPYD, PTK2, TYMS PTK2 2/4885CCNT1 132/4885CDK9 66/4885

“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.