SCHEMBL27454572

SCHEMBL27454572

Cn1cc(-c2nc3c(-c4ccc(CNC(=O)c5nc(C(C)(C)C)no5)c(C(F)(F)F)c4)ccnc3[nH]2)c(NC(=O)/C=C/CN2CCOCC2)n1

nearest known ligand 0.50

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ BTK Q06187 20/20 0.50
▸ LCK P06239 2/20 0.46

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
SCHEMBL30950519 0.92 BTK (0.50) BTKLCK
SCHEMBL27463032 0.92 BTK (0.50) BTKLCK
SCHEMBL27454575 0.91 BTK (0.50) BTKLCK
SCHEMBL27460368 0.89 BTK (0.46) BTKLCK
SCHEMBL27454437 0.89 BTK (0.49) BTKLCK
SCHEMBL27454573 0.87 BTK (0.48) BTKLCK
SCHEMBL27452621 0.85 BTK (0.56) BTKLCK
SCHEMBL30950568 0.85 BTK (0.49) BTKLCK
SCHEMBL27457680 0.85 BTK (0.49) BTKLCK
SCHEMBL27454435 0.84 BTK (0.48) 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
WO-2024129395-A1 BTK INHIBITORS GWYNANT THERAPEUTICS, INC. (US) 2024-06-20 — — WO disclosed
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