SCHEMBL24071944

SCHEMBL24071944

CCN(c1cc(-c2ccc(N3CCNCC3)nc2)cc(C(=O)NCc2c3c(c(C)[nH]c2=O)CCCC3)c1C)C1CCOCC1

nearest known ligand 0.88

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ EZH2 Q15910 19/20 0.88
▸ EZH1 Q92800 2/20 0.73
▸ HDAC1 Q13547 1/20 0.66
▸ HDAC6 Q9UBN7 1/20 0.66

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
SCHEMBL16935365 0.96 EZH2 (0.92) EZH2EZH1HDAC1HDAC6
SCHEMBL16935285 0.96 EZH2 (0.92) EZH2EZH1HDAC1HDAC6
SCHEMBL20111746 0.94 EZH2 (1.00) EZH2EZH1HDAC1HDAC6
SCHEMBL29412236 0.94 EZH2 (1.00) EZH2EZH1HDAC1HDAC6
SCHEMBL31189809 0.94 EZH2 (1.00) EZH2EZH1HDAC1HDAC6
SCHEMBL21284967 0.92 EZH2 (0.87) EZH2EZH1HDAC1HDAC6
SCHEMBL21284965 0.92 EZH2 (0.87) EZH2EZH1HDAC1HDAC6
SCHEMBL24072447 0.92 EZH2 (0.90) EZH2EZH1HDAC1HDAC6
SCHEMBL16935172 0.90 EZH2 (0.82) EZH2EZH1HDAC1HDAC6
SCHEMBL13277721 0.90 EZH2 (1.00) EZH2HDAC1HDAC6

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-2021238007-A1 BIFUNCTIONAL COMPOUND AND PHARMACEUTICAL COMPOSITION CAPABLE OF INDUCING DEGRADATION OF CORE SUBUNITS OF PRC2 PROTEIN COMPLEX, AND USE 四川大学华西医院 2021-12-02 — — WO disclosed
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