SCHEMBL8017263

SCHEMBL8017263

CCOC(=O)[C@@H](O)CN(C(=O)N[C@@H](Cc1ccccc1)C(=O)O)C(C)C

nearest known ligand 0.52

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MME P08473 10/20 0.52
ACE P12821 6/20 0.52
CPA1 P15085 2/20 0.46
ACE2 Q9BYF1 2/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
CA12 O43570 1/20 0.45
CA1 P00915 1/20 0.45
CA9 Q16790 1/20 0.45
MMP8 P22894 1/20 0.44
LMNA P02545 1/20 0.43
CTSL P07711 1/20 0.43
LPAR1 Q92633 1/20 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
SCHEMBL8017258 1.00 MME (0.52) MMEACECPA1ACE2L3MBTL1
SCHEMBL8016970 0.89 MME (0.63) MMEACECPA1ACE2L3MBTL1
SCHEMBL8016965 0.89 MME (0.63) MMEACECPA1ACE2L3MBTL1
SCHEMBL8017176 0.87 MME (0.59) MMEACECPA1ACE2
SCHEMBL8017182 0.87 MME (0.59) MMEACECPA1ACE2
SCHEMBL8027201 0.86 MME (0.51) MMEACECPA1ACE2L3MBTL1
SCHEMBL8027205 0.86 MME (0.51) MMEACECPA1ACE2L3MBTL1
SCHEMBL8017273 0.85 MME (0.72) MMEACECPA1ACE2L3MBTL1
SCHEMBL8017270 0.85 MME (0.72) MMEACECPA1ACE2L3MBTL1
SCHEMBL8017424 0.84 MME (0.57) MMEACEL3MBTL1LPAR1

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