SCHEMBL27454067

SCHEMBL27454067

CC(C)n1cc(NC(=O)/C=C/CN(C)C)c(-c2nc3c(-c4ccc(CNC(=O)c5nc(C(C)(C)C)no5)c(F)c4)ccnc3[nH]2)n1

nearest known ligand 0.52

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ BTK Q06187 20/20 0.52
▸ LCK P06239 2/20 0.50

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
SCHEMBL30950550 1.00 BTK (0.52) BTKLCK
SCHEMBL27454148 0.93 BTK (0.54) BTKLCK
SCHEMBL30950551 0.91 BTK (0.56) BTKLCK
SCHEMBL27454153 0.91 BTK (0.56) BTKLCK
SCHEMBL27460184 0.91 BTK (0.47) BTKLCK
SCHEMBL30950447 0.88 BTK (0.53) BTKLCK
SCHEMBL27452106 0.88 BTK (0.53) BTKLCK
SCHEMBL30950556 0.86 BTK (0.46) BTKLCK
SCHEMBL27454230 0.86 BTK (0.46) BTKLCK
SCHEMBL27458329 0.85 BTK (0.60) 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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