SCHEMBL22659399

SCHEMBL22659399

Cc1cc(-c2ccnc(NC(=O)C3CC3)c2)ccc1CNC(=O)c1nc(C(C)(C)C)co1

nearest known ligand 0.45

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ GSK3B P49841 18/20 0.45
▸ MAPK14 Q16539 6/20 0.43
▸ ABL1 P00519 1/20 0.41
▸ PIK3C3 Q8NEB9 1/20 0.41

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
SCHEMBL29533555 1.00 GSK3B (0.45) GSK3BMAPK14ABL1PIK3C3
SCHEMBL29533503 0.84 GSK3B (0.45) GSK3BMAPK14ABL1PIK3C3
SCHEMBL22659510 0.84 GSK3B (0.45) GSK3BMAPK14ABL1PIK3C3
SCHEMBL22664846 0.84 BTK (0.51) GSK3BMAPK14ABL1
SCHEMBL22659500 0.84 GSK3B (0.46) GSK3BMAPK14ABL1PIK3C3
SCHEMBL29532930 0.84 GSK3B (0.46) GSK3BMAPK14ABL1PIK3C3
Hydrochloric Acid SCHEMBL29533241 0.84 BTK (0.51) GSK3BMAPK14ABL1
Hydrochloric Acid SCHEMBL22659441 0.84 BTK (0.51) GSK3BMAPK14ABL1
SCHEMBL22659385 0.83 BTK (0.52) GSK3BMAPK14PIK3C3
SCHEMBL29533743 0.83 BTK (0.52) GSK3BMAPK14PIK3C3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12240838-B2 Inhibiting agents for Bruton's tyrosine kinase BIOGEN MA INC. (US) 2025-03-04 — — US disclosed
US-20220259194-A1 INHIBITING AGENTS FOR BRUTON'S TYROSINE KINASE BIOGEN MA INC. 2022-08-18 — — US disclosed
WO-2020232330-A1 INHIBITING AGENTS FOR BRUTON'S TYROSINE KINASE BIOGEN MA INC. (US) 2020-11-19 — — WO disclosed
WO-2020232330-A1 INHIBITING AGENTS FOR BRUTON'S TYROSINE KINASE BIOGEN MA INC. (US) 2020-11-19 — — WO 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 (2 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-12240838-B2 Inhibiting agents for Bruton's tyrosine kinase ABL1, BTK, LYN GSK3B 318/4885MAPK14 266/4885ABL1 1/4885
US-20220259194-A1 INHIBITING AGENTS FOR BRUTON'S TYROSINE KINASE ABL1, BTK, LYN GSK3B 318/4885MAPK14 266/4885ABL1 1/4885

“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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