SCHEMBL8016944

SCHEMBL8016944

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

nearest known ligand 0.85

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MME P08473 18/20 0.85
ACE P12821 15/20 0.85
ACE2 Q9BYF1 7/20 0.52
CPA1 P15085 6/20 0.52

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
SCHEMBL8016940 1.00 MME (0.85) MMEACEACE2CPA1
SCHEMBL8029444 0.94 MME (0.76) MMEACEACE2CPA1
SCHEMBL8029449 0.94 MME (0.76) MMEACEACE2CPA1
SCHEMBL8016997 0.94 MME (0.75) MMEACE
SCHEMBL8016991 0.94 MME (0.75) MMEACE
SCHEMBL8017210 0.92 MME (0.74) MMEACEACE2CPA1
SCHEMBL8032863 0.92 MME (1.00) MMEACEACE2CPA1
SCHEMBL8033719 0.92 MME (1.00) MMEACEACE2CPA1
SCHEMBL8028021 0.92 MME (1.00) MMEACEACE2CPA1
SCHEMBL8027291 0.92 MME (1.00) 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-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