SCHEMBL7570068

SCHEMBL7570068

CC(C)CC[C@@H](CN(CC(C)C)C(=O)N[C@@H](Cc1ccc(-c2ccccc2)cc1)C(=O)O)C(=O)NO

nearest known ligand 0.70

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MME P08473 17/20 0.70
ACE P12821 16/20 0.70
CPA1 P15085 10/20 0.52
ACE2 Q9BYF1 10/20 0.52
MMP2 P08253 1/20 0.47
MMP7 P09237 1/20 0.47
MMP9 P14780 1/20 0.47
MMP12 P39900 1/20 0.47
MMP13 P45452 1/20 0.47

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
SCHEMBL7570067 1.00 MME (0.70) MMEACECPA1ACE2MMP2
SCHEMBL7567465 0.93 MME (0.66) MMEACECPA1ACE2MMP2
SCHEMBL7567456 0.93 MME (0.66) MMEACECPA1ACE2MMP2
SCHEMBL7566359 0.93 MME (0.71) MMEACECPA1ACE2MMP2
SCHEMBL7566363 0.93 MME (0.71) MMEACECPA1ACE2MMP2
SCHEMBL7568199 0.91 MME (0.76) MMEACECPA1ACE2
SCHEMBL7567309 0.91 MME (0.76) MMEACECPA1ACE2
SCHEMBL7568195 0.91 MME (0.76) MMEACECPA1ACE2
SCHEMBL7575104 0.88 MME (0.71) MMEACECPA1ACE2
SCHEMBL7575097 0.88 MME (0.71) 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