SCHEMBL8448568

SCHEMBL8448568

CC(C)CN(CC(O)C(=O)O)C(=O)NC(CC(=O)O)c1ccc2ccccc2c1

nearest known ligand 0.63

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ MME P08473 12/20 0.63
▸ ACE P12821 12/20 0.63
▸ UTS2R Q9UKP6 5/20 0.42
▸ MMP9 P14780 1/20 0.41

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
SCHEMBL8455768 0.92 MME (0.53) MMEACEUTS2R
SCHEMBL8447805 0.91 MME (0.52) MMEACEUTS2RMMP9
SCHEMBL8447801 0.90 MME (0.52) MMEACEUTS2R
SCHEMBL8448729 0.88 MME (0.52) MMEACEUTS2R
SCHEMBL8447368 0.88 MME (0.58) MMEACE
SCHEMBL8448427 0.86 MME (0.48) MMEACEUTS2R
SCHEMBL8455345 0.86 ACE (0.46) MMEACEUTS2RMMP9
SCHEMBL8448622 0.86 POLB (0.48) MMEACEUTS2R
SCHEMBL8447359 0.86 UTS2R (0.47) MMEACEUTS2R
SCHEMBL8448677 0.85 MME (0.47) MMEACEMMP9

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
US-5891912-A ENDOPEPTIDASE 24.11 INHIBITORS SANTEN PHARMACEUTICAL CO., LTD. (JP) 1999-04-06 — — US claimed
US-5891912-A ENDOPEPTIDASE 24.11 INHIBITORS SANTEN PHARMACEUTICAL CO., LTD. (JP) 1999-04-06 — — US disclosed
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