SCHEMBL30950453

SCHEMBL30950453

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

nearest known ligand 0.57

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ BTK Q06187 20/20 0.57
▸ LCK P06239 2/20 0.55

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
SCHEMBL30950498 0.93 BTK (0.60) BTKLCK
SCHEMBL27457635 0.93 BTK (0.48) BTKLCK
SCHEMBL30950544 0.93 BTK (0.48) BTKLCK
SCHEMBL27457796 0.92 BTK (0.47) BTKLCK
SCHEMBL30950448 0.92 BTK (0.47) BTKLCK
SCHEMBL27458329 0.90 BTK (0.60) BTKLCK
SCHEMBL27454153 0.86 BTK (0.56) BTKLCK
SCHEMBL30950551 0.86 BTK (0.56) BTKLCK
SCHEMBL30950567 0.86 BTK (0.51) BTKLCK
SCHEMBL27457759 0.86 BTK (0.51) 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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