SCHEMBL7573264

SCHEMBL7573264

CC(=O)NCCOC(=O)[C@H](CN(CC(C)C)C(=O)N[C@@H](Cc1ccc(-c2ccccc2)cc1)C(=O)O)OCc1ccccc1

nearest known ligand 0.58

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MME P08473 12/20 0.58
ACE P12821 11/20 0.58
CTSB P07858 1/20 0.42
ITGB3 P05106 1/20 0.41
ITGAV P06756 1/20 0.41
CPA1 P15085 4/20 0.41
ACE2 Q9BYF1 4/20 0.41
GPR34 Q9UPC5 2/20 0.40

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
SCHEMBL7573257 1.00 MME (0.58) MMEACECTSBITGB3ITGAV
SCHEMBL8446420 0.94 MME (0.50) MMEACECTSBITGB3ITGAV
SCHEMBL7572261 0.89 MME (0.66) MMEACECTSBITGB3ITGAV
SCHEMBL7572256 0.89 MME (0.66) MMEACECTSBITGB3ITGAV
SCHEMBL8446421 0.88 MME (0.43) MMEACECTSB
SCHEMBL7567275 0.88 MME (0.62) MMEACECPA1ACE2
SCHEMBL7567282 0.88 MME (0.62) MMEACECPA1ACE2
SCHEMBL8027176 0.88 MME (0.73) MMEACECPA1ACE2
SCHEMBL7570155 0.86 MME (0.70) MMEACECTSBCPA1ACE2
SCHEMBL7567672 0.85 MME (0.61) MMEACEITGB3ITGAVCPA1

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