SCHEMBL11116592

SCHEMBL11116592

Nc1ccc(C(=O)NCCC(=O)NO)cc1

nearest known ligand 0.77

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 15/20 0.77
HDAC3 O15379 14/20 0.77
HDAC2 Q92769 14/20 0.77
HDAC6 Q9UBN7 13/20 0.77
HDAC4 P56524 12/20 0.77
HDAC7 Q8WUI4 12/20 0.77
HDAC10 Q969S8 12/20 0.77
HDAC11 Q96DB2 12/20 0.77
HDAC8 Q9BY41 12/20 0.77
HDAC9 Q9UKV0 12/20 0.77
HDAC5 Q9UQL6 12/20 0.77
KDM4E B2RXH2 1/20 0.54
MAPT P10636 1/20 0.54
HIF1A Q16665 1/20 0.54
SLC22A6 Q4U2R8 1/20 0.54
SLC22A8 Q8TCC7 1/20 0.54
LMNA P02545 2/20 0.54
SLC22A2 O15244 1/20 0.54
SLC22A1 O15245 1/20 0.54
ALDH1A1 P00352 1/20 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
SCHEMBL8204261 0.91 HDAC1 (0.74) HDAC1HDAC3HDAC2HDAC6HDAC4
SCHEMBL8209916 0.90 HDAC1 (0.88) HDAC1HDAC3HDAC2HDAC6HDAC4
SCHEMBL14147866 0.87 HDAC1 (0.83) HDAC1HDAC3HDAC2HDAC6HDAC4
SCHEMBL4342942 0.87 HDAC1 (1.00) HDAC1HDAC3HDAC2HDAC6HDAC4
SCHEMBL8209336 0.87 HDAC1 (1.00) HDAC1HDAC3HDAC2HDAC6HDAC4
SCHEMBL14066864 0.85 HDAC2 (0.75) HDAC1HDAC3HDAC2HDAC6HDAC4
SCHEMBL8201955 0.85 HDAC1 (0.79) HDAC1HDAC3HDAC2HDAC6HDAC4
SCHEMBL8209982 0.84 HDAC1 (0.82) HDAC1HDAC3HDAC2HDAC6HDAC4
SCHEMBL9344489 0.83 KDM4E (0.68) HDAC1HDAC3HDAC2HDAC6HDAC4
SCHEMBL14067956 0.82 HDAC1 (0.67) HDAC1HDAC3HDAC2HDAC6HDAC4

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
EP-0061406-B1 BENZAMIDO-ALKYL-HYDROXAMIC-ACID DERIVATIVES, PREPARATION THEREOF AND THERAPEUTICAL COMPOSITION LABORATOIRE L. LAFON Société anonyme dite: (FR) 1984-06-13 EP claimed
US-4407822-A SEDATIVES LABORATOIRE L. LAFON (FR) 1983-10-04 US disclosed