SCHEMBL31476012

SCHEMBL31476012

C=CC(=O)N1CCN(c2ncc3ncnc(Nc4ccc(Oc5cc6ncnn6cc5C)c(C)c4)c3n2)C[C@H]1C

nearest known ligand 0.48

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ERBB2 P04626 4/20 0.48
EGFR P00533 4/20 0.48
BRAF P15056 12/20 0.39
BTK Q06187 3/20 0.38

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
SCHEMBL25999393 0.90 ERBB2 (0.53) ERBB2EGFR
SCHEMBL26428664 0.90 ERBB2 (0.53) ERBB2EGFR
SCHEMBL25432531 0.90 ERBB2 (0.53) ERBB2EGFR
SCHEMBL30575895 0.83 EGFR (0.41) ERBB2EGFRBRAF
SCHEMBL25428777 0.83 EGFR (0.41) ERBB2EGFRBRAF
SCHEMBL25428782 0.83 EGFR (0.41) ERBB2EGFRBRAF
SCHEMBL31476116 0.83 EGFR (0.52) ERBB2EGFRBRAF
SCHEMBL25429678 0.83 ERBB2 (0.49) ERBB2EGFR
SCHEMBL31475763 0.82 EGFR (0.42) ERBB2EGFRBRAF
SCHEMBL29309676 0.82 ERBB2 (0.53) ERBB2EGFR

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-20250129078-A1 ERBB2 INHIBITORS COGENT BIOSCIENCES, INC. 2025-04-24 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-20250129078-A1 ERBB2 INHIBITORS ERBB2, ERBB3, EGFR ERBB2 1/4885EGFR 3/4885BRAF 95/4885

“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.