SCHEMBL30345305

SCHEMBL30345305

CSCC[C@H](N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(N)=O)C(=O)O

nearest known ligand 0.65

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ CTSC P53634 3/20 0.65
▸ MEN1 O00255 1/20 0.59
▸ KMT2A Q03164 1/20 0.59
▸ ACE P12821 2/20 0.55
▸ CCKBR P32239 3/20 0.52
▸ CCKAR P32238 1/20 0.52
▸ ERAP2 Q6P179 1/20 0.52
▸ ECE1 P42892 4/20 0.52
▸ ALOX15 P16050 1/20 0.51
▸ MMP1 P03956 1/20 0.51

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
SCHEMBL30929480 0.95 CTSC (0.58) CTSCMEN1KMT2AACECCKBR
SCHEMBL30051830 0.93 CTSC (0.71) CTSCMEN1KMT2AACEERAP2
SCHEMBL30083936 0.93 CTSC (0.60) CTSCMEN1KMT2AACECCKBR
SCHEMBL30053106 0.93 CTSC (0.69) CTSCMEN1KMT2AACECCKBR
SCHEMBL13154782 0.92 CTSC (0.73) CTSCMEN1KMT2AACEECE1
SCHEMBL7048700 0.92 CTSC (0.73) CTSCMEN1KMT2AACEECE1
SCHEMBL7048698 0.92 CTSC (0.73) CTSCMEN1KMT2AACEECE1
SCHEMBL7049417 0.92 CTSC (0.73) CTSCMEN1KMT2AACEECE1
SCHEMBL30103434 0.91 CTSC (0.56) CTSCMEN1KMT2AACECCKBR
SCHEMBL30052005 0.91 CTSC (0.69) CTSCMEN1KMT2AACEERAP2

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-110732018-B Preparation method of tuna meat ACE inhibitory peptide chewable tablets 浙江海洋大学 2023-04-07 — — CN disclosed
Send feedback