SCHEMBL7569374

SCHEMBL7569374

CN(CC(CCc1ccccc1)C(=O)OCc1ccccc1)C(=O)N[C@@H](Cc1ccc(-c2ccccc2)cc1)C(=O)O

nearest known ligand 0.54

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ACE P12821 10/20 0.52
MME P08473 9/20 0.52
ACE2 Q9BYF1 7/20 0.52
CPA1 P15085 6/20 0.52
ITGB3 P05106 1/20 0.44
ITGAV P06756 1/20 0.44
MMP3 P08254 1/20 0.44
CTSL P07711 2/20 0.44
GPR34 Q9UPC5 2/20 0.43

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
SCHEMBL7569380 1.00 ACE (0.52) ACEMMEACE2CPA1ITGB3
SCHEMBL8450814 0.95 MME (0.46) ACEMMEACE2CPA1MMP3
SCHEMBL7570145 0.90 MME (0.58) ACEMMEACE2CPA1MMP3
SCHEMBL7570142 0.90 MME (0.58) ACEMMEACE2CPA1MMP3
SCHEMBL7569388 0.89 MME (0.53) ACEMMEACE2CPA1CTSL
SCHEMBL7569398 0.89 MME (0.53) ACEMMEACE2CPA1CTSL
SCHEMBL7568928 0.87 MME (0.64) ACEMMEACE2CPA1MMP3
SCHEMBL7568362 0.87 MME (0.64) ACEMMEACE2CPA1MMP3
SCHEMBL7568368 0.87 MME (0.64) ACEMMEACE2CPA1MMP3
SCHEMBL7567864 0.87 ACE (0.51) ACEMMEACE2CPA1ITGB3

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 2 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
EP-0798291-A1 NOVEL 1,3-DIALKYLUREA DERIVATIVES SANTEN PHARMACEUTICAL CO., LTD. (JP) 1997-10-01 EP disclosed