SCHEMBL22659934

SCHEMBL22659934

CC(C)(C)c1nc(C(=O)NCc2ccc(-c3ccnc(NC(=O)C4CC4)c3)cc2C2CC2)no1

nearest known ligand 0.49

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ BTK Q06187 10/20 0.49
▸ LCK P06239 1/20 0.44
▸ GSK3B P49841 9/20 0.43
▸ CYP3A4 P08684 1/20 0.40
▸ AAK1 Q2M2I8 1/20 0.40
▸ MAPK14 Q16539 1/20 0.40

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
SCHEMBL29532990 1.00 BTK (0.49) BTKLCKGSK3BCYP3A4AAK1
SCHEMBL22659486 0.97 BTK (0.48) BTKLCKGSK3B
SCHEMBL29533956 0.97 BTK (0.48) BTKLCKGSK3B
SCHEMBL22659668 0.90 BTK (0.50) BTKLCKGSK3BMAPK14
SCHEMBL29533875 0.90 BTK (0.50) BTKLCKGSK3BMAPK14
SCHEMBL22664661 0.90 BTK (0.54) BTKLCKGSK3BMAPK14
SCHEMBL22660085 0.90 BTK (0.50) BTKLCKGSK3BMAPK14
SCHEMBL29533262 0.90 BTK (0.50) BTKLCKGSK3BMAPK14
Hydrochloric Acid SCHEMBL22659335 0.89 BTK (0.53) BTKLCKGSK3BMAPK14
SCHEMBL22659699 0.89 BTK (0.54) BTKLCKGSK3B

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 BTK 2/4885LCK 8/4885GSK3B 318/4885
US-20220259194-A1 INHIBITING AGENTS FOR BRUTON'S TYROSINE KINASE ABL1, BTK, LYN BTK 2/4885LCK 8/4885GSK3B 318/4885

“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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