SCHEMBL11272121

SCHEMBL11272121

CC(=O)SCCCC(=O)N1CC(=O)C[C@H]1C(=O)O

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ACE P12821 4/20 0.43
HDAC3 O15379 2/20 0.35
HDAC4 P56524 2/20 0.35
HDAC1 Q13547 2/20 0.35
HDAC7 Q8WUI4 2/20 0.35
HDAC2 Q92769 2/20 0.35
HDAC10 Q969S8 2/20 0.35
HDAC11 Q96DB2 2/20 0.35
HDAC8 Q9BY41 2/20 0.35
HDAC6 Q9UBN7 2/20 0.35
HDAC9 Q9UKV0 2/20 0.35
HDAC5 Q9UQL6 2/20 0.35
PREP P48147 2/20 0.34
POLB P06746 1/20 0.32

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
SCHEMBL11215621 0.92 ACE (0.50) ACEPOLB
SCHEMBL11259700 0.83 ACE (0.41) ACEPOLB
SCHEMBL11263453 0.80 ACE (0.41) ACEPOLB
SCHEMBL11272976 0.79 ACE (0.49) ACEHDAC3HDAC1HDAC10HDAC11
SCHEMBL11261402 0.78 ACE (0.45) ACE
SCHEMBL11265881 0.75 ACE (0.58) ACE
SCHEMBL16967407 0.75 ACE (0.54) ACE
Water SCHEMBL5570206 0.74 ACE (0.52) ACE
SCHEMBL11268004 0.74 ACE (0.53) ACE
SCHEMBL11210160 0.74 ACE (0.37) ACEHDAC3HDAC4HDAC1HDAC7

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
US-4330548-A HYPOTENSIVE AGENTS E. R. SQUIBB & SONS, INC. (US) 1982-05-18 US disclosed
US-4296113-A FOR TREATING HYPERTENSION BY INHIBITING ANGIOTENSIN CONVERTING ENZYME E. R. SQUIBB & SONS, INC. (US) 1981-10-20 US disclosed