SCHEMBL25254803

SCHEMBL25254803

C=CC(=O)N(C)C1CCCN(c2cnccc2-c2ccc(CNC(=O)c3ncc(C(C)(C)C)o3)c(C)c2)C1

nearest known ligand 0.41

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ BTK Q06187 15/20 0.41
▸ DGAT2 Q96PD7 3/20 0.34
▸ ROCK2 O75116 1/20 0.34
▸ ATR Q13535 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
SCHEMBL29418625 1.00 BTK (0.41) BTKDGAT2ROCK2ATR
SCHEMBL29418539 0.91 BTK (0.40) BTKDGAT2ROCK2
SCHEMBL25249361 0.91 BTK (0.40) BTKDGAT2ROCK2
SCHEMBL31213007 0.90 BTK (0.42) BTKDGAT2ATR
SCHEMBL25270137 0.89 BTK (0.43) BTK
SCHEMBL29418561 0.89 BTK (0.43) BTK
SCHEMBL31213008 0.88 BTK (0.39) BTKDGAT2ROCK2ATR
SCHEMBL25251063 0.88 BTK (0.41) BTKDGAT2ROCK2ATR
SCHEMBL29418601 0.88 BTK (0.41) BTKDGAT2ROCK2ATR
SCHEMBL25220113 0.87 BTK (0.43) BTKDGAT2

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-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

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 1/4885DGAT2 4024/4885ROCK2 250/4885

“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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