SCHEMBL8027487

SCHEMBL8027487

CCOC(=O)C(O)CN(CC(C)C)C(=O)N[C@@H](Cc1ccc(OC)cc1)C(=O)O

nearest known ligand 0.65

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MME P08473 13/20 0.65
ACE P12821 9/20 0.65
KMT2A Q03164 1/20 0.46
FPR2 P25090 1/20 0.46
CA2 P00918 1/20 0.44
LDHA P00338 1/20 0.43
CPA1 P15085 1/20 0.43
ACE2 Q9BYF1 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
SCHEMBL8027491 1.00 MME (0.65) MMEACEKMT2AFPR2CA2
SCHEMBL8032604 0.91 MME (0.77) MMEACEKMT2AFPR2CA2
SCHEMBL8032597 0.91 MME (0.77) MMEACEKMT2AFPR2CA2
SCHEMBL8032929 0.90 MME (0.69) MMEACECPA1ACE2
SCHEMBL8032932 0.90 MME (0.69) MMEACECPA1ACE2
SCHEMBL8032839 0.89 MME (0.81) MMEACECA2CPA1ACE2
SCHEMBL8032844 0.89 MME (0.81) MMEACECA2CPA1ACE2
SCHEMBL8017270 0.89 MME (0.72) MMEACECPA1ACE2
SCHEMBL8017273 0.89 MME (0.72) MMEACECPA1ACE2
SCHEMBL8027335 0.88 MME (0.82) 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