SCHEMBL30950558

SCHEMBL30950558

CC(C)(C)c1noc(C(=O)NCc2ccc(-c3ccnc(N)c3N)cc2Cl)n1

nearest known ligand 0.54

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ BTK Q06187 17/20 0.54
▸ LCK P06239 1/20 0.49
▸ KDM4E B2RXH2 1/20 0.42
▸ MAPT P10636 1/20 0.42
▸ KMT2A Q03164 1/20 0.42
▸ EPHX2 P34913 1/20 0.40
▸ NR1H4 Q96RI1 1/20 0.40
▸ KLKB1 P03952 1/20 0.38

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
SCHEMBL27457768 1.00 BTK (0.54) BTKLCKKDM4EMAPTKMT2A
SCHEMBL17645776 0.89 BTK (0.67) BTKLCK
SCHEMBL30950500 0.89 BTK (0.67) BTKLCK
SCHEMBL30950478 0.88 BTK (0.50) BTKLCKKDM4EMAPTKMT2A
SCHEMBL30950434 0.88 BTK (0.56) BTKLCKKMT2A
SCHEMBL27456675 0.88 BTK (0.53) BTKLCK
SCHEMBL30950479 0.88 BTK (0.53) BTKLCK
SCHEMBL27457649 0.88 BTK (0.56) BTKLCKKMT2A
SCHEMBL30950455 0.81 BTK (0.50) BTKLCKKDM4EMAPTKMT2A
SCHEMBL27458164 0.81 BTK (0.50) BTKLCKKDM4EMAPTKMT2A

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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