SCHEMBL27458164

SCHEMBL27458164

CC(C)(C)c1noc(C(=O)NCc2ccc(-c3ccnc4[nH]c(-c5ccccc5N)nc34)cc2Cl)n1

nearest known ligand 0.50

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ BTK Q06187 19/20 0.50
▸ LCK P06239 1/20 0.48
▸ KDM4E B2RXH2 1/20 0.40
▸ MAPT P10636 1/20 0.40
▸ KMT2A Q03164 1/20 0.40

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
SCHEMBL30950455 1.00 BTK (0.50) BTKLCKKDM4EMAPTKMT2A
SCHEMBL17645863 0.91 BTK (0.61) BTKLCK
SCHEMBL30950483 0.91 BTK (0.61) BTKLCK
SCHEMBL27440806 0.91 BTK (0.52) BTKLCKKDM4EMAPTKMT2A
SCHEMBL30950534 0.90 BTK (0.49) BTKLCK
SCHEMBL27456677 0.90 BTK (0.49) BTKLCK
SCHEMBL30950467 0.89 BTK (0.48) BTKLCKKDM4EMAPTKMT2A
SCHEMBL30950488 0.87 BTK (0.47) BTKLCKKDM4EMAPTKMT2A
SCHEMBL27453493 0.87 BTK (0.47) BTKLCKKDM4EMAPTKMT2A
SCHEMBL27457769 0.87 BTK (0.52) 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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