SCHEMBL9928280

SCHEMBL9928280

CC1CCN(Cc2c[nH]c3ncnc(Nc4ccc(F)c(Cl)c4)c23)CC1

nearest known ligand 0.54

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
EGFR P00533 19/20 0.54
ERBB2 P04626 2/20 0.54
LCK P06239 1/20 0.54
KDR P35968 1/20 0.54
CCNA2 P20248 1/20 0.49
CDK2 P24941 1/20 0.49
CCNA1 P78396 1/20 0.49

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
SCHEMBL9904005 0.92 EGFR (0.65) EGFRERBB2LCKKDRCCNA2
SCHEMBL9928293 0.92 ERBB2 (0.44) EGFRERBB2LCKKDR
SCHEMBL9928282 0.87 EGFR (0.53) EGFRERBB2
SCHEMBL9928290 0.85 MERTK (0.39) EGFRERBB2LCKKDR
SCHEMBL9898652 0.85 EGFR (0.51) EGFRERBB2LCKKDRCCNA2
SCHEMBL9898650 0.85 EGFR (0.51) EGFRERBB2LCKKDRCCNA2
SCHEMBL9898657 0.85 EGFR (0.51) EGFRERBB2LCKKDRCCNA2
SCHEMBL9898224 0.83 AAK1 (0.56) EGFRERBB2LCKKDR
SCHEMBL9928315 0.83 EGFR (0.53) EGFRERBB2LCKKDR
SCHEMBL9928289 0.82 AXL (0.39) EGFRERBB2KDR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120149902-A1 PYRROLO[2,3-D]PYRIMIDINE DERIVATIVE UBE INDUSTRIES, LTD. (JP) 2012-06-14 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-20120149902-A1 PYRROLO[2,3-D]PYRIMIDINE DERIVATIVE ERBB2, EGFR, FGFR1 EGFR 2/4885ERBB2 1/4885LCK 43/4885

“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.