SCHEMBL28915529

SCHEMBL28915529

CC(C)(C)c1noc(C(=O)NCc2ccc(-c3nn(C4CCCCO4)c4ncc(-c5ccc(C6CCN(C(=O)O)CC6)cc5)cc34)cc2F)n1

nearest known ligand 0.45

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ BTK Q06187 18/20 0.45
▸ LCK P06239 1/20 0.42
▸ EGFR P00533 3/20 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
SCHEMBL28915516 0.94 BTK (0.38) BTKLCKEGFR
SCHEMBL23816035 0.93 BTK (0.43) BTKLCKEGFR
SCHEMBL28961423 0.92 BTK (0.43) BTKLCKEGFR
SCHEMBL23816550 0.87 WNT3A (0.38) BTKLCKEGFR
SCHEMBL23815998 0.86 BTK (0.48) BTKLCKEGFR
SCHEMBL23816440 0.86 BTK (0.42) BTKLCKEGFR
SCHEMBL26115894 0.83 BTK (0.42) BTKLCKEGFR
SCHEMBL23816562 0.79 BTK (0.40) BTKLCKEGFR
SCHEMBL23816086 0.75 BTK (0.53) BTKLCK
Hydrochloric Acid SCHEMBL30063399 0.75 BTK (0.53) 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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