SCHEMBL30883151

SCHEMBL30883151

COC(=O)c1ccc2ccn(Cc3ccc(OCCOCC(=O)OC(C)(C)C)cc3)c2c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC8 Q9BY41 5/20 0.52
HDAC6 Q9UBN7 5/20 0.52
HDAC3 O15379 4/20 0.52
HDAC1 Q13547 4/20 0.52
HDAC2 Q92769 4/20 0.52
HDAC10 Q969S8 3/20 0.52
HDAC11 Q96DB2 2/20 0.52
HDAC4 P56524 1/20 0.52
HDAC7 Q8WUI4 1/20 0.52
HDAC9 Q9UKV0 1/20 0.52
HDAC5 Q9UQL6 1/20 0.52
NCOR2 Q9Y618 1/20 0.52
KDM4E B2RXH2 2/20 0.44
ALDH1A1 P00352 2/20 0.44
HPGD P15428 2/20 0.44
POLB P06746 1/20 0.44
APOBEC3A P31941 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
HSD17B10 Q99714 1/20 0.44
APOBEC3G Q9HC16 1/20 0.44

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
SCHEMBL30883174 0.99 HDAC8 (0.51) HDAC8HDAC6HDAC3HDAC1HDAC2
SCHEMBL30883168 0.99 HDAC8 (0.51) HDAC8HDAC6HDAC3HDAC1HDAC2
SCHEMBL30883172 0.99 HDAC8 (0.51) HDAC8HDAC6HDAC3HDAC1HDAC2
SCHEMBL30883150 0.89 HDAC8 (0.53) HDAC8HDAC6HDAC3HDAC1HDAC2
SCHEMBL30883158 0.88 HDAC8 (0.52) HDAC8HDAC6HDAC3HDAC1HDAC2
SCHEMBL30883161 0.87 HDAC8 (0.52) HDAC8HDAC6HDAC3HDAC1HDAC2
SCHEMBL30883164 0.87 HDAC8 (0.52) HDAC8HDAC6HDAC3HDAC1HDAC2
SCHEMBL26325692 0.84 HDAC8 (0.56) HDAC8HDAC6HDAC3HDAC1HDAC2
SCHEMBL26325689 0.84 HDAC8 (0.56) HDAC8HDAC6HDAC3HDAC1HDAC2
SCHEMBL26325678 0.84 HDAC8 (0.56) HDAC8HDAC6HDAC3HDAC1HDAC2

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
CN-117736201-A Targeted histone deacetylase 8 proteolytic chimera, preparation method and application thereof 深圳大学 2024-03-22 CN disclosed