SCHEMBL23304256

SCHEMBL23304256

Cc1cc(-c2ccnc3cc(N4CCOCC4)nn23)ccc1CNC(=O)O

nearest known ligand 0.49

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ CFTR P13569 5/20 0.49
▸ BRAF P15056 3/20 0.49
▸ EGLN1 Q9GZT9 1/20 0.42
▸ WNT3A P56704 1/20 0.40
▸ PIK3CA P42336 3/20 0.39
▸ DGAT1 O75907 5/20 0.39
▸ PIK3CD O00329 2/20 0.39
▸ MTOR P42345 1/20 0.39
▸ PIK3CG P48736 1/20 0.39
▸ SOAT1 P35610 4/20 0.39
▸ RAF1 P04049 1/20 0.38
▸ KLKB1 P03952 1/20 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
SCHEMBL29840395 0.89 CFTR (0.46) CFTRBRAFEGLN1PIK3CAPIK3CD
SCHEMBL23337488 0.89 CFTR (0.46) CFTRBRAFEGLN1PIK3CAPIK3CD
SCHEMBL23336692 0.85 BRAF (0.46) CFTRBRAFWNT3APIK3CADGAT1
Hydrochloric Acid SCHEMBL23303955 0.84 BRAF (0.45) CFTRBRAFWNT3APIK3CADGAT1
SCHEMBL23303785 0.84 BTK (0.50) CFTRBRAFEGLN1
SCHEMBL23303990 0.80 MEN1 (0.41) CFTRWNT3A
SCHEMBL23303716 0.76 BTK (0.47) —
SCHEMBL27167883 0.74 MEN1 (0.36) CFTRWNT3A
SCHEMBL25238414 0.73 PIK3CB (0.40) BRAFEGLN1PIK3CAPIK3CDPIK3CG
SCHEMBL4658348 0.69 BRAF (0.77) BRAFRAF1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230025892-A1 CONDENSED BI-HETEROCYCLES AS INHIBITING AGENTS FOR BRUTON'S TYROSINE KINASE BIOGEN MA INC. 2023-01-26 — — US disclosed
WO-2021087112-A1 CONDENSED BI-HETEROCYCLES AS INHIBITING AGENTS FOR BRUTON'S TYROSINE KINASE BIOGEN MA INC. (US) 2021-05-06 — — 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 (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-20230025892-A1 CONDENSED BI-HETEROCYCLES AS INHIBITING AGENTS FOR BRUTON'S TYROSINE KINASE ABL1, CDK1, CDK2 CFTR 4425/4885BRAF 118/4885EGLN1 1582/4885

“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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