SCHEMBL8016965

SCHEMBL8016965

CC(C)N(CC(O)C(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)O

nearest known ligand 0.63

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MME P08473 14/20 0.63
ACE P12821 11/20 0.63
CPA1 P15085 2/20 0.48
ACE2 Q9BYF1 2/20 0.48
L3MBTL1 Q9Y468 1/20 0.48

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
SCHEMBL8016970 1.00 MME (0.63) MMEACECPA1ACE2L3MBTL1
SCHEMBL8026904 0.94 MME (0.73) MMEACECPA1ACE2
SCHEMBL8026903 0.94 MME (0.73) MMEACECPA1ACE2
SCHEMBL8017258 0.89 MME (0.52) MMEACECPA1ACE2L3MBTL1
SCHEMBL8017263 0.89 MME (0.52) MMEACECPA1ACE2L3MBTL1
SCHEMBL8027283 0.87 MME (0.75) MMEACECPA1ACE2
SCHEMBL8016955 0.86 MME (0.64) MMEACECPA1ACE2
SCHEMBL8017182 0.85 MME (0.59) MMEACECPA1ACE2
SCHEMBL8017176 0.85 MME (0.59) MMEACECPA1ACE2
SCHEMBL8028951 0.84 ACE (0.58) 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-0738711-B1 NOVEL 1,3-DIALKYLUREA DERIVATIVE HAVING HYDROXYL GROUP SANTEN PHARMACEUTICAL CO LTD (JP) 2000-03-08 EP disclosed
EP-0738711-A1 NOVEL 1,3-DIALKYLUREA DERIVATIVE HAVING HYDROXYL GROUP SANTEN PHARMACEUTICAL CO., LTD. (JP) 1996-10-23 EP disclosed