SCHEMBL7569072

SCHEMBL7569072

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

nearest known ligand 0.67

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MME P08473 18/20 0.67
ACE P12821 15/20 0.67
ACE2 Q9BYF1 8/20 0.47
CPA1 P15085 7/20 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
SCHEMBL7569066 1.00 MME (0.67) MMEACEACE2CPA1
SCHEMBL7566357 0.93 MME (0.64) MMEACEACE2CPA1
SCHEMBL7566353 0.93 MME (0.64) MMEACEACE2CPA1
SCHEMBL7569076 0.93 MME (0.69) MMEACEACE2CPA1
SCHEMBL7569070 0.93 MME (0.69) MMEACEACE2CPA1
SCHEMBL8450793 0.90 MME (0.54) MMEACE
SCHEMBL7568195 0.90 MME (0.76) MMEACEACE2CPA1
SCHEMBL7567309 0.90 MME (0.76) MMEACEACE2CPA1
SCHEMBL7568199 0.90 MME (0.76) MMEACEACE2CPA1
SCHEMBL8027331 0.89 MME (0.82) 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 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