SCHEMBL2637361

SCHEMBL2637361

CN1Cc2ccnc(Nc3nc(Nc4ccc(CP(=O)(O)O)cc4)ncc3C(F)(F)F)c2C1=O

nearest known ligand 0.45

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ KIT P10721 1/20 0.45
▸ FLT3 P36888 1/20 0.45
▸ PTK2 Q05397 15/20 0.44
▸ AURKA O14965 1/20 0.42
▸ LRRK2 Q5S007 2/20 0.42
▸ FGFR1 P11362 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
SCHEMBL2034467 0.89 PTK2 (0.44) KITFLT3PTK2LRRK2
SCHEMBL2034472 0.86 PTK2 (0.44) KITFLT3PTK2AURKALRRK2
SCHEMBL2637079 0.86 KIT (0.43) KITFLT3PTK2AURKALRRK2
SCHEMBL15227404 0.86 KIT (0.43) KITFLT3PTK2AURKALRRK2
SCHEMBL2032989 0.82 LRRK2 (0.44) KITFLT3PTK2AURKALRRK2
SCHEMBL2637440 0.80 LRRK2 (0.43) KITFLT3PTK2AURKALRRK2
SCHEMBL2636859 0.80 LRRK2 (0.49) PTK2LRRK2
SCHEMBL2637631 0.80 EGFR (0.44) KITFLT3PTK2LRRK2FGFR1
SCHEMBL2637046 0.80 CHEK1 (0.46) KITFLT3PTK2LRRK2FGFR1
SCHEMBL2637349 0.80 LRRK2 (0.45) KITFLT3PTK2AURKALRRK2

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
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
EP-2438056-A2 AMINO PYRIMIDINE ANTICANCER COMPOUNDS OSI Pharmaceuticals, LLC (US) 2012-04-11 — — EP 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 (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-20130231306-A1 AMINO PYRIMIDINE ANTICANCER COMPOUNDS DPYD, PTK2, TYMS KIT 1208/4885FLT3 27/4885PTK2 2/4885

“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.

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