SCHEMBL29533826

SCHEMBL29533826

Cc1c(CNC(=O)c2nc(C(C)(C)C)no2)ccc(-c2ccnc(NC(=O)C3CC3)c2)c1F

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ BTK Q06187 12/20 0.53
▸ LCK P06239 1/20 0.47
▸ MAPK14 Q16539 4/20 0.41
▸ GSK3B P49841 5/20 0.40
▸ CDK1 P06493 2/20 0.39
▸ CDK2 P24941 2/20 0.39
▸ CDK9 P50750 2/20 0.39
▸ CDK3 Q00526 2/20 0.39
▸ CDK5 Q00535 2/20 0.39
▸ GSK3A P49840 1/20 0.39
▸ CCNT1 O60563 1/20 0.39
▸ CCNB1 P14635 1/20 0.39
▸ CCNE1 P24864 1/20 0.39
▸ CCNA1 P78396 1/20 0.39
▸ CDK5R1 Q15078 1/20 0.39

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
SCHEMBL22659710 1.00 BTK (0.53) BTKLCKMAPK14GSK3BCDK1
SCHEMBL29533081 0.94 BTK (0.53) BTKLCKMAPK14GSK3BCDK1
SCHEMBL22659452 0.94 BTK (0.53) BTKLCKMAPK14GSK3BCDK1
SCHEMBL22660078 0.92 BTK (0.52) BTKLCKMAPK14GSK3BCDK1
SCHEMBL29533277 0.92 BTK (0.52) BTKLCKMAPK14GSK3BCDK1
SCHEMBL22659653 0.91 BTK (0.52) BTKLCKMAPK14GSK3BCDK1
SCHEMBL29533542 0.91 BTK (0.52) BTKLCKMAPK14GSK3BCDK1
SCHEMBL22659773 0.91 BTK (0.55) BTKLCKMAPK14GSK3BCDK1
SCHEMBL29533566 0.91 BTK (0.55) BTKLCKMAPK14GSK3BCDK1
SCHEMBL22659928 0.90 BTK (0.54) BTKLCKMAPK14GSK3BCDK1

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-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
EP-3969124-A1 INHIBITING AGENTS FOR BRUTON'S TYROSINE KINASE Biogen MA Inc. (US) 2022-03-23 — — EP 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 BTK 2/4885LCK 8/4885MAPK14 266/4885
US-20220259194-A1 INHIBITING AGENTS FOR BRUTON'S TYROSINE KINASE ABL1, BTK, LYN BTK 2/4885LCK 8/4885MAPK14 266/4885

“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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