SCHEMBL2034962

SCHEMBL2034962

CCOP(C)(=O)Cc1ccc(Nc2ncc(C(F)(F)F)c(Nc3ccc(Br)c4c3C(=O)N(C)C4)n2)cc1

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LRRK2 Q5S007 4/20 0.43
FLT3 P36888 2/20 0.40
KIT P10721 1/20 0.40
PTK2 Q05397 13/20 0.39
JAK2 O60674 1/20 0.38
NTRK1 P04629 1/20 0.38
TYK2 P29597 1/20 0.38
KDR P35968 1/20 0.38
JAK3 P52333 1/20 0.38
PTK2B Q14289 1/20 0.38
NTRK3 Q16288 1/20 0.38
NTRK2 Q16620 1/20 0.38
CHEK1 O14757 1/20 0.37
MAP4K1 Q92918 1/20 0.37

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
SCHEMBL2029803 0.93 LRRK2 (0.44) LRRK2FLT3KITPTK2JAK2
SCHEMBL15226723 0.90 LRRK2 (0.44) LRRK2FLT3KITPTK2JAK2
SCHEMBL2031962 0.90 LRRK2 (0.42) LRRK2FLT3KITPTK2JAK2
SCHEMBL12643600 0.90 LRRK2 (0.42) LRRK2FLT3KITPTK2JAK2
SCHEMBL2032458 0.89 LRRK2 (0.42) LRRK2FLT3KITPTK2JAK2
SCHEMBL2032989 0.89 LRRK2 (0.44) LRRK2FLT3KITPTK2JAK2
SCHEMBL2028462 0.88 LRRK2 (0.44) LRRK2FLT3KITPTK2JAK2
SCHEMBL2034898 0.86 FLT3 (0.41) LRRK2FLT3KITPTK2CHEK1
SCHEMBL2028959 0.86 FLT3 (0.41) LRRK2FLT3KITPTK2CHEK1
SCHEMBL2034861 0.86 LRRK2 (0.40) LRRK2FLT3KITPTK2JAK2

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 LRRK2 854/4885FLT3 27/4885KIT 1208/4885
US-20110136764-A1 AMINO PYRIMIDINE ANTICANCER COMPOUNDS DPYD, PTK2, TYMS LRRK2 854/4885FLT3 27/4885KIT 1208/4885

“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.