SCHEMBL2035831

SCHEMBL2035831

CCOP(=O)(Cc1ccc(Nc2ncc(C(F)(F)F)c(Nc3cccc4c3C(=O)N(C)CC4)n2)cc1)OCC

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ PTK2 Q05397 11/20 0.47
▸ BTK Q06187 2/20 0.46
▸ CHEK1 O14757 1/20 0.44
▸ KIT P10721 1/20 0.44
▸ FLT3 P36888 1/20 0.44
▸ MAP4K1 Q92918 2/20 0.43
▸ ULK1 O75385 2/20 0.43
▸ LRRK2 Q5S007 1/20 0.43
▸ NPY5R Q15761 1/20 0.41
▸ JAK2 O60674 1/20 0.41
▸ NTRK1 P04629 1/20 0.41
▸ TYK2 P29597 1/20 0.41
▸ KDR P35968 1/20 0.41
▸ JAK3 P52333 1/20 0.41
▸ PTK2B Q14289 1/20 0.41
▸ NTRK3 Q16288 1/20 0.41
▸ NTRK2 Q16620 1/20 0.41

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
SCHEMBL2637046 0.89 CHEK1 (0.46) PTK2BTKCHEK1KITFLT3
SCHEMBL2035225 0.83 PTK2 (0.49) PTK2BTKULK1NPY5RJAK2
SCHEMBL2037387 0.83 PTK2 (0.48) PTK2BTKNPY5RJAK2NTRK1
SCHEMBL2035832 0.83 PTK2 (0.44) PTK2CHEK1KITFLT3MAP4K1
SCHEMBL2028820 0.83 LRRK2 (0.43) PTK2BTKCHEK1KITFLT3
SCHEMBL2034802 0.83 PTK2 (0.44) PTK2BTKCHEK1KITFLT3
SCHEMBL2029803 0.82 LRRK2 (0.44) PTK2BTKKITFLT3LRRK2
SCHEMBL2032361 0.82 PTK2 (0.45) PTK2BTKKITFLT3LRRK2
SCHEMBL2035262 0.82 EGFR (0.42) PTK2BTKFLT3MAP4K1LRRK2
SCHEMBL2033482 0.82 LRRK2 (0.43) PTK2BTKCHEK1KITFLT3

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 11 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-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-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
US-8399433-B2 Amino pyrimidine anticancer compounds OSI Pharmaceuticals, LLC (US) 2013-03-19 — — US disclosed
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
US-20110136764-A1 AMINO PYRIMIDINE ANTICANCER COMPOUNDS OSI PHARMACEUTICALS, INC. (US) 2011-06-09 — — US 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 2/4885BTK 42/4885CHEK1 26/4885
US-20110136764-A1 AMINO PYRIMIDINE ANTICANCER COMPOUNDS DPYD, PTK2, TYMS PTK2 2/4885BTK 42/4885CHEK1 26/4885

“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.

Send feedback