SCHEMBL2034436

SCHEMBL2034436

CCOP(=O)(Cc1ccc(Nc2ncc(C(F)(F)F)c(Nc3ccc(N4CCN(C(C(=O)O)C(C)(C)C)CC4)c4c3C(=O)N(C)C4)n2)cc1)OCC

nearest known ligand 0.40

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PTK2 Q05397 6/20 0.40
BTK Q06187 2/20 0.39
LRRK2 Q5S007 1/20 0.38
EGFR P00533 2/20 0.36
ALK Q9UM73 5/20 0.36
FGFR1 P11362 2/20 0.35
MAPK3 P27361 2/20 0.35

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
SCHEMBL2029941 0.91 ALK (0.45) PTK2ALK
SCHEMBL2035262 0.89 EGFR (0.42) PTK2BTKLRRK2EGFRALK
SCHEMBL2030570 0.89 PTK2 (0.41) PTK2BTKLRRK2EGFRALK
SCHEMBL2033368 0.89 ALK (0.46) EGFRALKMAPK3
SCHEMBL12587261 0.87 PTK2 (0.40) PTK2BTKLRRK2EGFRALK
SCHEMBL2034371 0.87 FGFR1 (0.43) PTK2BTKLRRK2FGFR1MAPK3
SCHEMBL2028833 0.86 FGFR1 (0.43) PTK2BTKLRRK2EGFRALK
SCHEMBL2035565 0.86 PTK2 (0.42) PTK2BTKLRRK2ALK
SCHEMBL2035568 0.85 EGFR (0.42) PTK2BTKLRRK2EGFRALK
SCHEMBL2034348 0.84 PTK2 (0.47) PTK2BTKLRRK2FGFR1

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 2/4885BTK 42/4885LRRK2 854/4885

“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.