SCHEMBL30063405

SCHEMBL30063405

Cc1cc(-c2n[nH]c3ncc(-c4ccc(CCO)cc4)cc23)ccc1CNC(=O)c1nc(C(C)(C)C)no1

nearest known ligand 0.41

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ BTK Q06187 19/20 0.41
▸ LCK P06239 1/20 0.40
▸ KIT P10721 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
SCHEMBL26114267 1.00 BTK (0.41) BTKLCKKIT
SCHEMBL23816213 0.91 BTK (0.41) BTKLCKKIT
SCHEMBL30063464 0.91 BTK (0.41) BTKLCKKIT
SCHEMBL28915536 0.85 BTK (0.39) BTKLCK
SCHEMBL30063476 0.85 BTK (0.44) BTKLCK
SCHEMBL30151517 0.85 BTK (0.41) BTKLCK
SCHEMBL23816068 0.85 BTK (0.44) BTKLCK
SCHEMBL23816318 0.84 BTK (0.39) BTKLCK
SCHEMBL23816195 0.82 BTK (0.38) BTKLCK
SCHEMBL30063526 0.82 BTK (0.38) BTKLCK

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-115335376-A Degradation of Bruton's Tyrosine Kinase (BTK) by conjugation of BTK inhibitor with E3 ligase ligand and methods of use thereof 百济神州有限公司 2022-11-11 — — CN disclosed
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