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SCHEMBL27466246

SCHEMBL27466246

C=CC(=O)Nc1cc(-c2cnc3[nH]c(-c4cccc(C)c4NC(=O)C=C)nc3c2-c2ccc(CNC(=O)c3nc(C(C)(C)C)no3)c(F)c2)c(C)cc1-c1nc2c(-c3ccc(CNC(=O)c4nc(C(C)(C)C)no4)c(F)c3)ccnc2[nH]1

nearest known ligand 0.47

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ BTK Q06187 20/20 0.47
▸ LCK P06239 2/20 0.47

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
SCHEMBL27453682 0.92 BTK (0.55) BTKLCK
SCHEMBL30950589 0.92 BTK (0.55) BTKLCK
SCHEMBL27453886 0.87 BTK (0.56) BTKLCK
SCHEMBL30950548 0.87 BTK (0.56) BTKLCK
SCHEMBL27453684 0.86 BTK (0.54) BTKLCK
SCHEMBL30950459 0.85 BTK (0.54) BTKLCK
SCHEMBL27453683 0.85 BTK (0.54) BTKLCK
SCHEMBL17645657 0.85 BTK (0.57) BTKLCK
SCHEMBL30950511 0.84 BTK (0.56) BTKLCK
SCHEMBL30950472 0.84 BTK (0.56) 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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