SCHEMBL29418334

SCHEMBL29418334

Cc1cc(-c2ncncc2N2CCCC(N(C)C(=O)OC(C)(C)C)C2)ccc1CNC(=O)c1cn(C(C)(C)C)nn1

nearest known ligand 0.46

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ BTK Q06187 9/20 0.46
▸ CYP46A1 Q9Y6A2 5/20 0.40
▸ PIK3CD O00329 1/20 0.38
▸ CRBN Q96SW2 1/20 0.38
▸ RET P07949 1/20 0.37
▸ KIF18A Q8NI77 1/20 0.34
▸ KLKB1 P03952 1/20 0.33
▸ DGAT2 Q96PD7 1/20 0.33
▸ GPR119 Q8TDV5 1/20 0.33

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
SCHEMBL25256931 0.92 BTK (0.47) BTKCYP46A1CRBNKLKB1DGAT2
SCHEMBL29418530 0.90 BTK (0.46) BTKCYP46A1CRBNKLKB1DGAT2
SCHEMBL25253128 0.90 BTK (0.46) BTKCYP46A1CRBNKLKB1DGAT2
SCHEMBL29418521 0.89 BTK (0.44) BTKPIK3CDCRBNRETKIF18A
SCHEMBL25243066 0.89 BTK (0.43) BTKPIK3CDCRBNRETKIF18A
SCHEMBL29418552 0.89 BTK (0.43) BTKPIK3CDCRBNRETKIF18A
SCHEMBL29418528 0.87 BTK (0.44) BTKPIK3CDCRBNRETKIF18A
SCHEMBL29418584 0.86 BTK (0.41) BTKPIK3CDCRBNRETKIF18A
SCHEMBL25249544 0.86 BTK (0.46) BTKCYP46A1CRBNKLKB1
SCHEMBL29418517 0.86 BTK (0.46) BTKCYP46A1CRBNKLKB1

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-20240327380-A1 BTK INHIBITORS BIOGEN MA INC. (US) 2024-10-03 — — US disclosed
EP-4192587-A1 BTK INHIBITORS Biogen MA Inc. (US) 2023-06-14 — — EP disclosed
WO-2022032019-A1 BTK INHIBITORS BIOGEN MA INC. (US) 2022-02-10 — — 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-20240327380-A1 BTK INHIBITORS BTK, SYK, LYN BTK 1/4885CYP46A1 3277/4885PIK3CD 80/4885

“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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