SCHEMBL7269013

SCHEMBL7269013

CCCC[C@H](NC(=O)[C@@H](CSCCOC(C)=O)Cc1cccc2ccccc12)C(=O)OC(C)(C)C

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ CTSK P43235 2/20 0.42
▸ CTSS P25774 1/20 0.42
▸ MME P08473 1/20 0.39
▸ ACE P12821 1/20 0.39
▸ CPA1 P15085 1/20 0.39
▸ ACE2 Q9BYF1 1/20 0.39
▸ HRH4 Q9H3N8 1/20 0.38
▸ CYP3A4 P08684 3/20 0.38
▸ REN P00797 5/20 0.37
▸ MMP9 P14780 2/20 0.37
▸ MMP1 P03956 1/20 0.37
▸ MMP3 P08254 1/20 0.37
▸ MMP2 P08253 1/20 0.36
▸ MMP8 P22894 1/20 0.36
▸ TACR1 P25103 1/20 0.36
▸ FNTA P49354 1/20 0.35
▸ PGGT1B P53609 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
SCHEMBL7278094 0.93 CTSK (0.42) CTSKCTSSMMEACECPA1
SCHEMBL7268814 0.91 CTSK (0.44) CTSKCTSSMMEACECPA1
SCHEMBL7273511 0.91 CTSK (0.44) CTSKCTSSMMEACECPA1
SCHEMBL7268176 0.90 CTSK (0.46) CTSKCTSSMMEACECPA1
SCHEMBL7278196 0.89 CTSK (0.41) CTSKCTSSMMEACECPA1
SCHEMBL7278187 0.89 CTSK (0.41) CTSKCTSSMMEACECPA1
SCHEMBL7267871 0.87 CTSK (0.40) CTSKCTSSMMEACECPA1
SCHEMBL7276468 0.87 CTSK (0.40) CTSKCTSSMMEACECPA1
SCHEMBL7267884 0.87 CTSK (0.40) CTSKCTSSMMEACECPA1
SCHEMBL7275937 0.86 CTSK (0.46) 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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