SCHEMBL7570145

SCHEMBL7570145

CN(C[C@H](CCc1ccccc1)C(=O)O)C(=O)N[C@@H](Cc1ccc(-c2ccccc2)cc1)C(=O)O

nearest known ligand 0.60

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MME P08473 12/20 0.58
ACE P12821 11/20 0.58
ACE2 Q9BYF1 10/20 0.58
CPA1 P15085 8/20 0.58
ITGB1 P05556 1/20 0.47
ITGA4 P13612 1/20 0.47
ITGB7 P26010 1/20 0.47
MMP3 P08254 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
SCHEMBL7570142 1.00 MME (0.58) MMEACEACE2CPA1ITGB1
SCHEMBL7569374 0.90 ACE (0.52) MMEACEACE2CPA1MMP3
SCHEMBL7569380 0.90 ACE (0.52) MMEACEACE2CPA1MMP3
SCHEMBL7568225 0.87 MME (0.57) MMEACEACE2CPA1
SCHEMBL7568219 0.87 MME (0.57) MMEACEACE2CPA1
SCHEMBL7568387 0.86 MME (0.71) MMEACEACE2CPA1
SCHEMBL7572405 0.86 MME (0.71) MMEACEACE2CPA1
SCHEMBL7572401 0.86 MME (0.71) MMEACEACE2CPA1
SCHEMBL7567269 0.86 MME (0.71) MMEACEACE2CPA1
SCHEMBL7573623 0.85 ACE (0.57) MMEACEACE2CPA1

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