SCHEMBL28616574

SCHEMBL28616574

COC(=O)c1ccc(NC(C)C)c(NC(=O)c2cn(C(C)=O)c3ccccc23)c1

nearest known ligand 0.65

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CREBBP Q92793 19/20 0.65
EP300 Q09472 2/20 0.58
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47

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
SCHEMBL28613828 0.86 CREBBP (0.71) CREBBPEP300
SCHEMBL28629136 0.85 CREBBP (0.83) CREBBPEP300
SCHEMBL28625677 0.84 CREBBP (0.82) CREBBPEP300
SCHEMBL28617526 0.83 CREBBP (0.84) CREBBPEP300
SCHEMBL28624532 0.79 CREBBP (1.00) CREBBPEP300
SCHEMBL28619686 0.79 CREBBP (0.77) CREBBPEP300
SCHEMBL28627104 0.76 CREBBP (0.67) CREBBPEP300KMT2A
SCHEMBL28629111 0.76 CREBBP (0.77) CREBBPEP300
SCHEMBL28614727 0.74 CREBBP (0.80) CREBBPEP300
SCHEMBL28617513 0.71 KDM4E (0.68) CREBBPEP300

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113321640-B Indole compound and application thereof 中国科学院广州生物医药与健康研究院 2023-06-09 CN disclosed
CN-109111427-B Indole compound and application thereof 中国科学院广州生物医药与健康研究院 2023-06-02 CN disclosed
CN-113321640-A Indole compound and application thereof 中国科学院广州生物医药与健康研究院 2021-08-31 CN disclosed