SCHEMBL27635504

SCHEMBL27635504

CC(C)CC(NC(=O)C(C)N(CC(=O)O)c1ccccc1)C(=O)O

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MME P08473 4/20 0.53
LTA4H P09960 1/20 0.44
GAA P10253 1/20 0.43
ACE P12821 1/20 0.43
CPA1 P15085 1/20 0.43
ACE2 Q9BYF1 1/20 0.43
ALDH1A1 P00352 1/20 0.43
GRN P28799 1/20 0.43
SORT1 Q99523 1/20 0.43
MMP2 P08253 1/20 0.42
MMP7 P09237 1/20 0.42
MMP9 P14780 1/20 0.42
MMP12 P39900 1/20 0.42
MMP13 P45452 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
SCHEMBL27693745 0.80 MME (0.53) MMELTA4HGAAACECPA1
SCHEMBL547805 0.78 SMN1; SMN2 (0.42) ALDH1A1
SCHEMBL9831516 0.77 MME (0.50) MMELTA4HMMP2MMP7MMP9
SCHEMBL6854264 0.77 MME (0.54) MMELTA4HACECPA1ACE2
SCHEMBL9813994 0.77 MME (0.58) MMELTA4HACECPA1ACE2
SCHEMBL3863960 0.75 ALDH1A1 (0.49) ALDH1A1
SCHEMBL27675065 0.74 MME (0.47) MMELTA4HALDH1A1MMP2MMP7
SCHEMBL7434243 0.74 MME (0.47) MMEGAAALDH1A1MMP2MMP7
SCHEMBL7275108 0.74 MME (0.47) MMEALDH1A1
SCHEMBL30414758 0.74 MME (0.52) MMELTA4HGAAACECPA1

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
CN-1726044-A Compositions and methods for enhancing mucosal delivery of Y2 receptor-binding peptides and methods for treating and preventing obesity NASTECH PHARM CO (US) 2006-01-25 CN disclosed