SCHEMBL7278179

SCHEMBL7278179

CCCC[C@H](NC(=O)[C@H](Cc1cccc2ccccc12)C[S+]([O-])C[C@H](COC(C)=O)OC(C)=O)C(=O)OC(C)(C)C

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ CTSK P43235 2/20 0.39
▸ CTSS P25774 1/20 0.39
▸ MME P08473 1/20 0.36
▸ ACE P12821 1/20 0.36
▸ CPA1 P15085 1/20 0.36
▸ ACE2 Q9BYF1 1/20 0.36
▸ REN P00797 9/20 0.35
▸ HRH4 Q9H3N8 1/20 0.35
▸ MMP9 P14780 2/20 0.34
▸ MMP3 P08254 2/20 0.34
▸ MMP1 P03956 1/20 0.34
▸ MMP2 P08253 2/20 0.34
▸ MMP8 P22894 1/20 0.34
▸ TACR1 P25103 1/20 0.33

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
SCHEMBL7278173 1.00 CTSK (0.39) CTSKCTSSMMEACECPA1
SCHEMBL7268515 0.88 CTSK (0.45) CTSKCTSSMMEACECPA1
SCHEMBL7267871 0.86 CTSK (0.40) CTSKCTSSMMEACECPA1
SCHEMBL7267884 0.86 CTSK (0.40) CTSKCTSSMMEACECPA1
SCHEMBL7269345 0.86 CTSK (0.40) CTSKCTSSMMEACECPA1
SCHEMBL7269350 0.86 CTSK (0.40) CTSKCTSSMMEACECPA1
SCHEMBL7276468 0.82 CTSK (0.40) CTSKCTSSMMEACECPA1
SCHEMBL7266699 0.81 CTSK (0.42) CTSKCTSSMMEACECPA1
SCHEMBL7278747 0.81 CTSK (0.39) CTSKCTSSMMEACECPA1
SCHEMBL7278741 0.81 CTSK (0.39) CTSKCTSSMMEACECPA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0377139-B1 N-substituted acylamino acid compounds, process for their production and their use BANYU PHARMA CO LTD (JP) 1995-07-12 — — EP disclosed
US-5424309-A Hypotensive agents BANYU PHARMACEUTICAL CO., LTD. (JP) 1995-06-13 — — US disclosed
EP-0377139-A1 N-substituted acylamino acid compounds, process for their production and their use Banyu Pharmaceutical Co., Ltd. (JP) 1990-07-11 — — EP disclosed
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