SCHEMBL27460366

SCHEMBL27460366

CN(C)C/C=C/C(=O)Nc1c(-c2nc3c(-c4ccc(CNC(=O)c5nc(C(C)(C)C)no5)c(C(F)(F)F)c4)ccnc3[nH]2)cnn1C

nearest known ligand 0.46

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ BTK Q06187 19/20 0.46
▸ LCK P06239 2/20 0.46
▸ CCNK O75909 1/20 0.36
▸ CDK12 Q9NYV4 1/20 0.36
▸ KCNH2 Q12809 1/20 0.34

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
SCHEMBL27454436 0.91 BTK (0.49) BTKLCKKCNH2
SCHEMBL27460368 0.89 BTK (0.46) BTKLCKKCNH2
SCHEMBL27454641 0.88 BTK (0.45) BTKLCKCCNKCDK12
SCHEMBL27454230 0.87 BTK (0.46) BTKLCKKCNH2
SCHEMBL30950556 0.87 BTK (0.46) BTKLCKKCNH2
SCHEMBL27454433 0.86 BTK (0.48) BTKLCKKCNH2
SCHEMBL27454577 0.86 BTK (0.43) BTKLCKCCNKCDK12
SCHEMBL27452692 0.85 BTK (0.51) BTKLCKKCNH2
SCHEMBL27460369 0.85 BTK (0.49) BTKLCKKCNH2
SCHEMBL30950447 0.81 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
WO-2024129395-A1 BTK INHIBITORS GWYNANT THERAPEUTICS, INC. (US) 2024-06-20 — — WO disclosed
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