SCHEMBL7569404

SCHEMBL7569404

CC(C)CN(CC(CCc1ccccc1)C(=O)NO)C(=O)N[C@@H](Cc1ccc2ccccc2c1)C(=O)O

nearest known ligand 0.69

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MME P08473 13/20 0.69
ACE P12821 13/20 0.69
CPA1 P15085 2/20 0.50
ACE2 Q9BYF1 2/20 0.50
MMP9 P14780 4/20 0.47
MMP8 P22894 4/20 0.47
MMP2 P08253 3/20 0.47
FCER2 P06734 1/20 0.46

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
SCHEMBL7572307 1.00 MME (0.69) MMEACECPA1ACE2MMP9
SCHEMBL7567514 0.92 MME (0.74) MMEACECPA1ACE2
SCHEMBL7569444 0.92 MME (0.74) MMEACECPA1ACE2
SCHEMBL7569434 0.92 MME (0.74) MMEACECPA1ACE2
SCHEMBL7573682 0.90 MME (0.71) MMEACECPA1ACE2FCER2
SCHEMBL7573678 0.90 MME (0.71) MMEACECPA1ACE2FCER2
SCHEMBL7567465 0.90 MME (0.66) MMEACECPA1ACE2MMP9
SCHEMBL7567456 0.90 MME (0.66) MMEACECPA1ACE2MMP9
SCHEMBL8447214 0.89 MME (0.55) MMEACEMMP9MMP8MMP2
SCHEMBL7575431 0.87 MME (0.67) MMEACECPA1ACE2

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-0798291-B1 NOVEL 1,3-DIALKYLUREA DERIVATIVES SANTEN PHARMACEUTICAL CO LTD (JP) 2002-09-11 EP disclosed
US-5968980-A ENDOPEPTIDASE 24.11 INHIBITORS SANTEN PHARMACEUTICAL CO., LTD. (JP) 1999-10-19 US disclosed
EP-0798291-A1 NOVEL 1,3-DIALKYLUREA DERIVATIVES SANTEN PHARMACEUTICAL CO., LTD. (JP) 1997-10-01 EP disclosed