SCHEMBL8469705

SCHEMBL8469705

CC(O)CCC[C@H](CC(=O)OC(C)(C)C)C(=O)N[C@@H](Cc1ccccc1)C(=O)O

nearest known ligand 0.50

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 11/20 0.50
MMP7 P09237 2/20 0.50
MMP9 P14780 1/20 0.50
MMP12 P39900 1/20 0.50
MMP13 P45452 1/20 0.50
ACE P12821 1/20 0.48
BIRC2 Q13490 1/20 0.48
MMP1 P03956 5/20 0.47
MMP3 P08254 5/20 0.47
ATM Q13315 1/20 0.46

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
SCHEMBL8828120 0.92 MMP2 (0.59) MMP2MMP7MMP9MMP1MMP3
SCHEMBL6294116 0.88 MMP2 (0.62) MMP2MMP7ACEBIRC2MMP1
SCHEMBL8468208 0.82 BIRC2 (0.46) MMP2MMP7MMP9ACEBIRC2
SCHEMBL8773904 0.81 MME (0.53) MMP2MMP7MMP9MMP12MMP13
SCHEMBL8828135 0.80 MMP3 (0.72) MMP2MMP7MMP9MMP1MMP3
SCHEMBL8828128 0.80 MMP1 (0.72) MMP2MMP7MMP9MMP1MMP3
SCHEMBL8773895 0.80 MME (0.54) MMP2MMP7MMP9MMP12MMP13
SCHEMBL8055025 0.79 MMP2 (0.77) MMP2MMP7MMP9MMP1MMP3
SCHEMBL8828145 0.79 MMP2 (0.61) MMP2MMP7MMP9MMP1MMP3
SCHEMBL4289468 0.79 ACE (0.54) MMP2MMP7MMP9MMP12MMP13

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-0749302-A4 HYDROXAMIC ACID AND CARBOXYLIC ACID DERIVATIVES, PROCESS FOR THEIR PREPARATION AND USE THEREOF SANOFI WINTHROP INC (US) 1999-08-25 EP disclosed
EP-0749302-A1 HYDROXAMIC ACID AND CARBOXYLIC ACID DERIVATIVES, PROCESS FOR THEIR PREPARATION AND USE THEREOF SANOFI WINTHROP, INC. (US) 1996-12-27 EP disclosed
WO-1995022966-A1 HYDROXAMIC ACID AND CARBOXYLIC ACID DERIVATIVES, PROCESS FOR THEIR PREPARATION AND USE THEREOF SANOFI WINTHROP, INC. (US) 1995-08-31 WO disclosed