SCHEMBL7782260

SCHEMBL7782260

CCN(CC)CC#CC(=O)Nc1ccc2ncnc(Nc3cccc(Br)c3)c2c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ EGFR P00533 20/20 1.00
▸ ERBB2 P04626 18/20 1.00
▸ ERBB4 Q15303 3/20 0.75
▸ ABCG2 Q9UNQ0 1/20 0.75

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
SCHEMBL30115365 0.93 EGFR (1.00) EGFRERBB2ERBB4ABCG2
SCHEMBL8142467 0.89 EGFR (1.00) EGFRERBB2ERBB4ABCG2
SCHEMBL30115314 0.87 EGFR (1.00) EGFRERBB2ERBB4ABCG2
SCHEMBL30115332 0.86 EGFR (0.84) EGFRERBB2ERBB4ABCG2
SCHEMBL29350449 0.86 EGFR (1.00) EGFRERBB2ERBB4ABCG2
SCHEMBL412104 0.86 EGFR (1.00) EGFRERBB2ERBB4ABCG2
SCHEMBL29350915 0.86 EGFR (1.00) EGFRERBB2ERBB4ABCG2
SCHEMBL7220947 0.86 EGFR (0.83) EGFRERBB2ERBB4ABCG2
SCHEMBL30115348 0.85 EGFR (1.00) EGFRERBB2ERBB4ABCG2
SCHEMBL30115316 0.84 EGFR (1.00) EGFRERBB2ERBB4ABCG2

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
US-20230001008-A1 COMPOSITIONS AND METHODS FOR TARGETING CELLULAR MOLECULES KUMQUAT BIOSCIENCES INC. 2023-01-05 — — US disclosed
WO-2021035096-A1 COMPOSITIONS AND METHODS FOR TARGETING CELLULAR MOLECULES KUMQUAT BIOSCIENCES INC. (US) 2021-02-25 — — WO disclosed
US-6251912-B1 Substituted quinazoline derivatives AMERICAN CYANAMID COMPANY 2001-06-26 — — 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-20230001008-A1 COMPOSITIONS AND METHODS FOR TARGETING CELLULAR MOLECULES CD2BP2, CD47, CD74 EGFR 1892/4885ERBB2 2230/4885ERBB4 2991/4885

“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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