SCHEMBL8772919

SCHEMBL8772919

CC(C)C[C@@H](C)C(=O)N[C@@H](Cc1cccc(C(=O)N(CCc2ccccc2)[C@H](C)C(=O)NO)c1)C(=O)O

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 1/20 0.49
MMP2 P08253 4/20 0.46
MMP7 P09237 3/20 0.46
MMP9 P14780 1/20 0.46
MMP12 P39900 1/20 0.46
MMP13 P45452 1/20 0.46
MMP1 P03956 3/20 0.45
MMP3 P08254 3/20 0.45
MMP8 P22894 1/20 0.43
FCER2 P06734 3/20 0.42
MEP1B Q16820 2/20 0.41
ACE P12821 2/20 0.41
ANPEP P15144 1/20 0.41
MME P08473 2/20 0.41
CPA1 P15085 1/20 0.41
ACE2 Q9BYF1 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
SCHEMBL8772916 0.77 MMP9 (0.66) MMP2MMP7MMP9MMP12MMP13
SCHEMBL15223639 0.75 MME (0.66) MMP2MMP7MMP9MMP12MMP13
SCHEMBL8772902 0.70 FCER2 (0.67) MMP2MMP7MMP9MMP12MMP13
SCHEMBL27496411 0.70 FCER2 (0.67) MMP2MMP7MMP9MMP12MMP13
SCHEMBL10087282 0.68 MME (0.60) MMP2MMP7MMP9MMP12MMP13
SCHEMBL13933747 0.67 MMP2 (0.60) MMP2MMP7MMP9MMP12MMP13
SCHEMBL10878801 0.67 MME (0.67) MMP2MMP7MMP9MMP12MMP13
SCHEMBL12781768 0.67 MME (0.67) MMP2MMP7MMP9MMP12MMP13
SCHEMBL27354283 0.66 FCER2 (0.67) MMP2MMP1MMP3FCER2ACE
SCHEMBL15223611 0.66 MME (0.74) FOLH1MMP2MMP7MMP9MMP12

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-0800510-A1 HYDROXAMIC ACID-CONTAINING INHIBITORS OF MATRIX METALLOPROTEASES THE PROCTER & GAMBLE COMPANY (US) 1997-10-15 EP disclosed
WO-1996020918-A1 HYDROXAMIC ACID-CONTAINING INHIBITORS OF MATRIX METALLOPROTEASES THE PROCTER & GAMBLE COMPANY (US) 1996-07-11 WO disclosed