SCHEMBL25216839

SCHEMBL25216839

Cc1cc(-c2ncncc2N2CCN(C(=O)OC(C)(C)C)CC2)ccc1CNC(=O)c1nnn(C(C)(C)C)n1

nearest known ligand 0.40

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ CYP46A1 Q9Y6A2 2/20 0.40
▸ GPR119 Q8TDV5 2/20 0.39
▸ BTK Q06187 8/20 0.38
▸ SMN1; SMN2 Q16637 3/20 0.37
▸ MEN1 O00255 2/20 0.37
▸ KMT2A Q03164 2/20 0.37
▸ CYP2C19 P33261 1/20 0.37
▸ WNT3A P56704 1/20 0.37
▸ TBK1 Q9UHD2 1/20 0.36
▸ KIT P10721 1/20 0.36
▸ HDAC6 Q9UBN7 1/20 0.35
▸ CKS1B P61024 1/20 0.35
▸ SKP1 P63208 1/20 0.35
▸ SKP2 Q13309 1/20 0.35
▸ HTT P42858 1/20 0.35
▸ NPSR1 Q6W5P4 1/20 0.35
▸ MAPT P10636 1/20 0.35
▸ TSHR P16473 1/20 0.35

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
SCHEMBL29418478 1.00 CYP46A1 (0.40) CYP46A1GPR119BTKSMN1; SMN2MEN1
SCHEMBL25211784 0.90 BTK (0.46) CYP46A1BTK
SCHEMBL29418518 0.90 BTK (0.46) CYP46A1BTK
Hydrochloric Acid SCHEMBL30352424 0.87 BTK (0.39) CYP46A1BTK
Hydrochloric Acid SCHEMBL25208653 0.87 BTK (0.39) CYP46A1BTK
Hydrochloric Acid SCHEMBL29418347 0.87 BTK (0.39) CYP46A1BTK
Hydrochloric Acid SCHEMBL25248110 0.87 BTK (0.39) CYP46A1BTK
SCHEMBL25214690 0.85 BTK (0.51) CYP46A1GPR119BTKSMN1; SMN2MEN1
SCHEMBL29418616 0.85 BTK (0.51) CYP46A1GPR119BTKSMN1; SMN2MEN1
SCHEMBL25212569 0.84 BTK (0.49) CYP46A1GPR119BTKSMN1; SMN2MEN1

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
CN-116917279-A BTK inhibitors 渤健马萨诸塞州股份有限公司 2023-10-20 — — CN disclosed
EP-4192587-A1 BTK INHIBITORS Biogen MA Inc. (US) 2023-06-14 — — 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 (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 CYP46A1 3277/4885GPR119 1014/4885BTK 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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