SCHEMBL6256519

SCHEMBL6256519

COCC[C@H](C(=O)O)C(C(=O)N[C@@H](Cc1ncc(-c2ccc(Cl)cc2)o1)C(=O)O)C1CCCC1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MME P08473 10/20 0.64
NPPA P01160 6/20 0.64
MMP13 P45452 2/20 0.41
NOTUM Q6P988 1/20 0.37
ACE P12821 3/20 0.36
CPA1 P15085 3/20 0.36
ACE2 Q9BYF1 3/20 0.36
NPC1 O15118 2/20 0.36
RAB9A P51151 2/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
HDAC3 O15379 1/20 0.35
HDAC4 P56524 1/20 0.35
HDAC1 Q13547 1/20 0.35
HDAC7 Q8WUI4 1/20 0.35
HDAC2 Q92769 1/20 0.35
HDAC10 Q969S8 1/20 0.35
HDAC11 Q96DB2 1/20 0.35
HDAC8 Q9BY41 1/20 0.35
HDAC6 Q9UBN7 1/20 0.35
HDAC9 Q9UKV0 1/20 0.35

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
SCHEMBL6255992 0.93 MME (0.61) MMENPPANOTUMACECPA1
SCHEMBL6256523 0.78 MME (0.74) MMENPPAITGA4ITGB7ITGB1
SCHEMBL6255996 0.71 MME (0.73) MMENPPAITGA4ITGB1
SCHEMBL8334821 0.70 MME (0.64) MMENPPAITGA4ITGB7ITGB1
SCHEMBL489206 0.69 MME (0.56) MMEL3MBTL1HDAC8
SCHEMBL6807770 0.67 MME (0.60) MMENPPA
SCHEMBL6807772 0.67 MME (0.60) MMENPPA
SCHEMBL6806381 0.67 MME (0.67) MMENPPAITGA4ITGB7ITGB1
SCHEMBL6808651 0.66 MME (0.65) MMENPPAITGA4ITGB1
SCHEMBL6259873 0.66 MME (0.51) MMENPPAACECPA1ACE2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1578735-A1 CYCLOPENTYL GLUTARAMIDES AND THEIR USE AS NEUTRAL ENDOPEPTIDASE INHIBITORS Pfizer Limited (GB) 2005-09-28 EP claimed
WO-2004056787-A1 CYCLOPENTYL GLUTARAMIDES AND THEIR USE AS NEUTRAL ENDOPEPTIDASE INHIBITORS PFIZER LIMITED (GB) 2004-07-08 WO claimed
EP-1578735-A1 CYCLOPENTYL GLUTARAMIDES AND THEIR USE AS NEUTRAL ENDOPEPTIDASE INHIBITORS Pfizer Limited (GB) 2005-09-28 EP disclosed
WO-2004056787-A1 CYCLOPENTYL GLUTARAMIDES AND THEIR USE AS NEUTRAL ENDOPEPTIDASE INHIBITORS PFIZER LIMITED (GB) 2004-07-08 WO disclosed