SCHEMBL10108150

SCHEMBL10108150

Bc1cccc(Nc2ncnc3ccc(NC(=O)/C=C/CN(C)C)cc23)c1

nearest known ligand 0.80

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
EGFR P00533 20/20 0.80
ERBB2 P04626 15/20 0.80
KDR P35968 1/20 0.64
ERBB4 Q15303 2/20 0.59
JAK3 P52333 1/20 0.59

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
SCHEMBL14612050 0.90 EGFR (0.81) EGFRERBB2KDR
SCHEMBL3263605 0.89 EGFR (0.80) EGFRERBB2KDRERBB4JAK3
SCHEMBL5116945 0.89 EGFR (0.80) EGFRERBB2KDRERBB4JAK3
SCHEMBL867890 0.89 EGFR (1.00) EGFRERBB2KDRERBB4JAK3
SCHEMBL867889 0.89 EGFR (1.00) EGFRERBB2KDRERBB4JAK3
SCHEMBL14578395 0.89 EGFR (0.80) EGFRERBB2KDRERBB4JAK3
SCHEMBL3241300 0.89 EGFR (1.00) EGFRERBB2KDRERBB4JAK3
SCHEMBL3241297 0.89 EGFR (1.00) EGFRERBB2KDRERBB4JAK3
SCHEMBL30115339 0.89 EGFR (1.00) EGFRERBB2KDRERBB4JAK3
SCHEMBL7914891 0.83 FYN (0.78) EGFRERBB2ERBB4JAK3

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-20120077811-A1 PRODRUG FORMS OF KINASE INHIBITORS AND THEIR USE IN THERAPY AUCKLAND UNISERVICES LIMITED (NZ) 2012-03-29 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-20120077811-A1 PRODRUG FORMS OF KINASE INHIBITORS AND THEIR USE IN THERAPY NTRK3, TK1, TNNI3K EGFR 48/4885ERBB2 7/4885KDR 281/4885

“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.