SCHEMBL28629111

SCHEMBL28629111

CCCNc1ccc(C(=O)OC(C)(C)C)cc1NC(=O)c1cn(C(C)=O)c2ccccc12

nearest known ligand 0.77

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CREBBP Q92793 20/20 0.77
EP300 Q09472 2/20 0.53

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
SCHEMBL30395304 0.95 CREBBP (0.69) CREBBPEP300
SCHEMBL28615730 0.95 CREBBP (0.69) CREBBPEP300
SCHEMBL28619686 0.89 CREBBP (0.77) CREBBPEP300
SCHEMBL28630420 0.89 CREBBP (0.78) CREBBPEP300
SCHEMBL28617520 0.87 CREBBP (0.78) CREBBPEP300
SCHEMBL28616467 0.85 CREBBP (0.79) CREBBPEP300
SCHEMBL28613648 0.84 CREBBP (0.77) CREBBPEP300
SCHEMBL28613653 0.83 CREBBP (0.79) CREBBPEP300
SCHEMBL28614745 0.82 CREBBP (0.78) CREBBPEP300
SCHEMBL28631446 0.81 CREBBP (0.55) 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