SCHEMBL2567671

SCHEMBL2567671

Cc1ccc(CN2CC=C(CCC(=O)N(O)C(CC(=O)NO)C3=CCN(Cc4ccc(C)cc4)C3=O)C2=O)cc1

nearest known ligand 0.54

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 20/20 0.54
HDAC3 O15379 19/20 0.54
HDAC1 Q13547 19/20 0.54
HDAC2 Q92769 19/20 0.54
HDAC4 P56524 18/20 0.54
HDAC7 Q8WUI4 18/20 0.54
HDAC10 Q969S8 18/20 0.54
HDAC11 Q96DB2 18/20 0.54
HDAC8 Q9BY41 18/20 0.54
HDAC9 Q9UKV0 18/20 0.54
HDAC5 Q9UQL6 18/20 0.54

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
SCHEMBL2569348 0.92 HDAC1 (0.44) HDAC6HDAC3HDAC1HDAC2HDAC4
SCHEMBL2566634 0.90 HDAC1 (0.56) HDAC6HDAC3HDAC1HDAC2HDAC4
SCHEMBL2568556 0.88 HDAC1 (0.57) HDAC6HDAC3HDAC1HDAC2HDAC4
SCHEMBL2569515 0.86 HDAC1 (0.55) HDAC6HDAC3HDAC1HDAC2HDAC4
SCHEMBL2565416 0.85 HDAC1 (0.45) HDAC6HDAC3HDAC1HDAC2HDAC4
SCHEMBL2566167 0.84 HDAC1 (0.59) HDAC6HDAC3HDAC1HDAC2HDAC4
SCHEMBL2566704 0.83 HDAC2 (0.53) HDAC6HDAC3HDAC1HDAC2HDAC4
SCHEMBL2569502 0.81 HDAC1 (0.55) HDAC6HDAC3HDAC1HDAC2HDAC4
SCHEMBL2569498 0.81 HDAC3 (0.78) HDAC6HDAC3HDAC1HDAC2HDAC4
SCHEMBL2565161 0.72 HDAC3 (0.66) HDAC6HDAC3HDAC1HDAC2HDAC4

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
EP-1626961-B1 NOVEL 2-OXO-HETEROCYCLIC COMPOUNDS AND THE PHARMACEUTICAL COMPOSITIONS COMPRISING THE SAME KOREA RES INST OF BIOSCIENCE (KR) 2011-11-02 EP disclosed