SCHEMBL29110757

SCHEMBL29110757

Cn1nc2ccc(-c3cc(Cc4ccccc4)n(Cc4ccc(C(=O)NO)cc4)n3)cc2n1

nearest known ligand 0.71

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ HDAC6 Q9UBN7 19/20 0.71
▸ HDAC1 Q13547 14/20 0.71
▸ HDAC8 Q9BY41 12/20 0.71
▸ HDAC3 O15379 11/20 0.71
▸ HDAC2 Q92769 11/20 0.71
▸ HDAC10 Q969S8 11/20 0.71
▸ NCOR2 Q9Y618 11/20 0.71
▸ HDAC4 P56524 11/20 0.71
▸ HDAC7 Q8WUI4 10/20 0.71
▸ HDAC11 Q96DB2 10/20 0.71
▸ HDAC9 Q9UKV0 10/20 0.71
▸ HDAC5 Q9UQL6 10/20 0.71
▸ KCNH2 Q12809 1/20 0.42

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
SCHEMBL29110792 0.87 HDAC6 (0.67) HDAC6HDAC1HDAC8HDAC3HDAC2
SCHEMBL29605505 0.87 HDAC6 (0.67) HDAC6HDAC1HDAC8HDAC3HDAC2
SCHEMBL29110809 0.85 HDAC6 (0.66) HDAC6HDAC1HDAC8HDAC3HDAC2
SCHEMBL29606039 0.85 HDAC6 (0.66) HDAC6HDAC1HDAC8HDAC3HDAC2
SCHEMBL29110804 0.82 HDAC6 (0.67) HDAC6HDAC1HDAC8HDAC3HDAC2
SCHEMBL29606448 0.82 HDAC6 (0.67) HDAC6HDAC1HDAC8HDAC3HDAC2
SCHEMBL29110774 0.81 HDAC6 (0.63) HDAC6HDAC1HDAC8HDAC3HDAC2
SCHEMBL29605449 0.81 HDAC6 (0.63) HDAC6HDAC1HDAC8HDAC3HDAC2
SCHEMBL29110797 0.81 HDAC6 (0.73) HDAC6HDAC1HDAC8HDAC3HDAC2
SCHEMBL29110762 0.79 HDAC6 (0.58) HDAC6HDAC1HDAC8HDAC3HDAC2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114621194-B 4-methylene-N-hydroxybenzoamide compound and application thereof 沈阳药科大学 2023-08-29 — — CN disclosed
CN-114621194-A 4-methylene-N-hydroxybenzamide compound and application thereof 沈阳药科大学 2022-06-14 — — CN disclosed
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