SCHEMBL29124637

SCHEMBL29124637

Cc1cc(-c2[c]cncc2)ccc1CNC(=O)c1coc(C(C)(C)C)n1

nearest known ligand 0.41

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ BTK Q06187 18/20 0.41
▸ EPHX2 P34913 1/20 0.36
▸ DGAT2 Q96PD7 1/20 0.36

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
SCHEMBL29124728 0.83 BTK (0.53) BTKEPHX2
SCHEMBL29124706 0.83 BTK (0.51) BTKEPHX2
SCHEMBL29124814 0.80 BTK (0.46) BTKEPHX2
SCHEMBL29124777 0.79 BTK (0.39) BTKEPHX2DGAT2
SCHEMBL29124649 0.78 BTK (0.53) BTKEPHX2DGAT2
SCHEMBL29533503 0.75 GSK3B (0.45) BTK
SCHEMBL22659510 0.75 GSK3B (0.45) BTK
SCHEMBL29124756 0.75 KLKB1 (0.44) BTKEPHX2
SCHEMBL30599773 0.71 BTK (0.38) BTKDGAT2
Hydrochloric Acid SCHEMBL25269108 0.71 BTK (0.38) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116917279-A BTK inhibitors 渤健马萨诸塞州股份有限公司 2023-10-20 — — CN disclosed
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