SCHEMBL7569057

SCHEMBL7569057

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

nearest known ligand 0.67

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MME P08473 14/20 0.67
ACE P12821 12/20 0.67
CPA1 P15085 6/20 0.52
ACE2 Q9BYF1 6/20 0.52
ERAP2 Q6P179 2/20 0.45
ERAP1 Q9NZ08 2/20 0.45
LNPEP Q9UIQ6 2/20 0.45

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
SCHEMBL7569054 1.00 MME (0.67) MMEACECPA1ACE2ERAP2
SCHEMBL7575158 0.95 MME (0.60) MMEACECPA1ACE2ERAP2
SCHEMBL7575163 0.95 MME (0.60) MMEACECPA1ACE2ERAP2
SCHEMBL7567269 0.93 MME (0.71) MMEACECPA1ACE2
SCHEMBL7572405 0.93 MME (0.71) MMEACECPA1ACE2
SCHEMBL7575104 0.93 MME (0.71) MMEACECPA1ACE2
SCHEMBL7575097 0.93 MME (0.71) MMEACECPA1ACE2
SCHEMBL7568387 0.93 MME (0.71) MMEACECPA1ACE2
SCHEMBL7572401 0.93 MME (0.71) MMEACECPA1ACE2
SCHEMBL7569420 0.92 MME (0.72) 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 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