SCHEMBL19921139

SCHEMBL19921139

COC(=O)c1ccccc1Oc1nc(Nc2ccc(N3CCN(C)CC3)cc2OC)nc2ccn(C)c12

nearest known ligand 0.56

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ EGFR P00533 16/20 0.56
▸ PTK2 Q05397 4/20 0.56
▸ NUAK1 O60285 1/20 0.50
▸ NUAK2 Q9H093 1/20 0.50

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
SCHEMBL19921185 0.94 PTK2 (0.59) EGFRPTK2
SCHEMBL19921124 0.88 ALK (0.56) EGFRPTK2
SCHEMBL19921170 0.85 EGFR (0.55) EGFRPTK2
SCHEMBL19921168 0.82 ALK (0.65) EGFRPTK2NUAK1
SCHEMBL19921118 0.81 ALK (0.62) EGFRPTK2
SCHEMBL19921152 0.80 EGFR (0.50) EGFRPTK2NUAK1NUAK2
SCHEMBL19921145 0.80 DCLK1 (0.43) EGFRPTK2
SCHEMBL21099503 0.77 ALK (0.60) EGFRPTK2
SCHEMBL19921100 0.77 ALK (0.52) EGFRPTK2
SCHEMBL20546932 0.76 ALK (0.65) EGFRPTK2NUAK1NUAK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3290420-B1 PYRIMIDINE PYRROLE COMPOUND, PREPARATION METHOD THEREFOR, PHARMACEUTICAL COMPOSITION, AND USES THEREOF UNIV XIAMEN (CN) 2020-12-09 — — EP claimed
US-20180312508-A1 PYRIMIDOPYRROLE COMPOUNDS, METHOD FOR PREPARING THE SAME, PHARMACEUTICAL COMPOSITIONS COMPRISING THE SAME AND USES THEREOF XIAMEN UNIVERSITY (CN) 2018-11-01 — — US claimed
EP-3290420-A1 PYRIMIDINE PYRROLE COMPOUND, PREPARATION METHOD THEREFOR, PHARMACEUTICAL COMPOSITION, AND USES THEREOF Xiamen University (CN) 2018-03-07 — — EP claimed

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-20180312508-A1 PYRIMIDOPYRROLE COMPOUNDS, METHOD FOR PREPARING THE SAME, PHARMACEUTICAL COMPOSITIONS COMPRISING THE SAME AND USES THEREOF TPMT, DHPS, TYMP EGFR 3364/4885PTK2 4325/4885NUAK1 3158/4885

“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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