SCHEMBL7573208

SCHEMBL7573208

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

nearest known ligand 0.64

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MME P08473 12/20 0.64
ACE P12821 10/20 0.64
CTSB P07858 1/20 0.46
ACE2 Q9BYF1 4/20 0.45
CPA1 P15085 3/20 0.45
HPGDS O60760 1/20 0.45
MMP1 P03956 1/20 0.44
FCER2 P06734 1/20 0.44

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
SCHEMBL7575145 0.94 MME (0.62) MMEACECTSBACE2CPA1
SCHEMBL7567517 0.91 MME (0.77) MMEACEACE2CPA1
SCHEMBL7567925 0.91 MME (0.77) MMEACEACE2CPA1
SCHEMBL7568906 0.91 MME (0.77) MMEACEACE2CPA1
SCHEMBL7570511 0.88 MME (0.55) MMEACECTSBHPGDSMMP1
SCHEMBL7567474 0.87 MME (0.72) MMEACEACE2CPA1
SCHEMBL7570374 0.87 MME (0.62) MMEACECTSBACE2CPA1
SCHEMBL8029444 0.87 MME (0.76) MMEACEACE2CPA1HPGDS
SCHEMBL8029449 0.87 MME (0.76) MMEACEACE2CPA1HPGDS
SCHEMBL8017720 0.86 MME (0.85) 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 3 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
US-5968980-A ENDOPEPTIDASE 24.11 INHIBITORS SANTEN PHARMACEUTICAL CO., LTD. (JP) 1999-10-19 US disclosed
EP-0798291-A1 NOVEL 1,3-DIALKYLUREA DERIVATIVES SANTEN PHARMACEUTICAL CO., LTD. (JP) 1997-10-01 EP disclosed