SCHEMBL27432575

SCHEMBL27432575

CC(C)(C)c1noc(C(=O)NCc2ccc(-c3ccnc4[nH]c(-c5cn[nH]c5)nc34)cc2S(C)(=O)=O)n1

nearest known ligand 0.50

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ BTK Q06187 20/20 0.50
▸ LCK P06239 2/20 0.50
▸ KCNH2 Q12809 1/20 0.37

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
SCHEMBL27441047 0.90 BTK (0.51) BTKLCKKCNH2
SCHEMBL27452240 0.87 BTK (0.66) BTKLCKKCNH2
SCHEMBL27456677 0.86 BTK (0.49) BTKLCKKCNH2
SCHEMBL30950534 0.86 BTK (0.49) BTKLCKKCNH2
SCHEMBL27433350 0.85 BTK (0.48) BTKLCK
SCHEMBL27454785 0.84 BTK (0.49) BTKLCKKCNH2
SCHEMBL30950449 0.83 BTK (0.47) BTKLCKKCNH2
SCHEMBL27454727 0.83 BTK (0.48) BTKLCKKCNH2
SCHEMBL30950561 0.83 BTK (0.48) BTKLCKKCNH2
SCHEMBL30950443 0.82 BTK (0.46) BTKLCKKCNH2

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
Send feedback