SCHEMBL29418433

SCHEMBL29418433

Cc1cc(-c2ccncc2N2CCC[C@H](N(C)C(=O)OC(C)(C)C)C2)ccc1CN(C(=O)OC(C)(C)C)C(=O)c1cn(C(C)(C)C)nn1

nearest known ligand 0.35

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ RET P07949 2/20 0.35
▸ KDM4D Q6B0I6 1/20 0.34
▸ BTK Q06187 3/20 0.32
▸ AAK1 Q2M2I8 1/20 0.32
▸ GPR119 Q8TDV5 2/20 0.31
▸ PDE10A Q9Y233 1/20 0.31
▸ PIK3CD O00329 1/20 0.31
▸ KIF18A Q8NI77 1/20 0.31
▸ CYP46A1 Q9Y6A2 2/20 0.31
▸ ATR Q13535 1/20 0.30
▸ GPBAR1 Q8TDU6 1/20 0.30

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
SCHEMBL25216174 0.96 RET (0.32) RETKDM4DBTKGPR119CYP46A1
SCHEMBL25268724 0.96 RET (0.32) RETKDM4DBTKGPR119CYP46A1
SCHEMBL29418521 0.89 BTK (0.44) RETKDM4DBTKAAK1PIK3CD
SCHEMBL29418528 0.87 BTK (0.44) RETKDM4DBTKAAK1PIK3CD
SCHEMBL29418352 0.84 BTK (0.45) RETKDM4DBTKAAK1PDE10A
SCHEMBL29418362 0.83 KDM4D (0.40) RETKDM4DBTKAAK1GPR119
SCHEMBL29418505 0.81 PIK3CD (0.39) RETKDM4DBTKPIK3CDKIF18A
SCHEMBL25248305 0.80 BTK (0.46) BTKATR
SCHEMBL25248307 0.80 BTK (0.46) BTKATR
SCHEMBL29418431 0.80 PIK3CD (0.39) RETKDM4DBTKAAK1PDE10A

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 RET 225/4885KDM4D 1396/4885BTK 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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