SCHEMBL8026514

SCHEMBL8026514

CC(C)C[C@@H](C(=O)N[C@H](C(=O)Nc1ccccn1)C(C)(C)C)[C@H](O)C(=O)O

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 9/20 0.76
MMP3 P08254 6/20 0.76
MMP9 P14780 5/20 0.76
MMP2 P08253 5/20 0.69
MMP7 P09237 4/20 0.69
LMNA P02545 1/20 0.48
RAB9A P51151 1/20 0.48
POLB P06746 1/20 0.47
ADAM17 P78536 9/20 0.46
MMP8 P22894 3/20 0.46
MMP20 O60882 1/20 0.46
ADAMTS4 O75173 1/20 0.46
TNF P01375 1/20 0.46
MMP10 P09238 1/20 0.46
MMP12 P39900 1/20 0.46
MMP13 P45452 1/20 0.46
MMP14 P50281 1/20 0.46
MMP15 P51511 1/20 0.46
MMP16 P51512 1/20 0.46
MMP25 Q9NPA2 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
SCHEMBL8899210 1.00 MMP1 (0.76) MMP1MMP3MMP9MMP2MMP7
SCHEMBL8887821 1.00 MMP1 (0.76) MMP1MMP3MMP9MMP2MMP7
SCHEMBL8190115 0.91 MMP1 (0.77) MMP1MMP3MMP9MMP2MMP7
SCHEMBL8193036 0.91 MMP1 (0.77) MMP1MMP3MMP9MMP2MMP7
SCHEMBL9284717 0.86 MMP1 (1.00) MMP1MMP3MMP9MMP2MMP7
SCHEMBL7405420 0.84 MMP1 (0.65) MMP1MMP3MMP9MMP2MMP7
SCHEMBL7778120 0.83 MMP1 (0.65) MMP1MMP3MMP9MMP2MMP7
SCHEMBL7771809 0.83 MMP1 (0.64) MMP1MMP3MMP9MMP2MMP7
SCHEMBL7408645 0.82 MMP1 (0.62) MMP1MMP3MMP9MMP2MMP7
Solimastat SCHEMBL8189168 0.82 MMP1 (1.00) MMP1MMP3MMP9MMP2MMP7

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1997003966-A1 N-(AMINO ACID) SUBSTITUTED SUCCINIC ACID AMIDE DERIVATIVES AS METALLOPROTEINASE INHIBITORS BRITISH BIOTECH PHARMACEUTICALS LIMITED (GB) 1997-02-06 WO claimed
EP-0861226-B1 SYNTHESIS OF CARBOXYLIC ACID DERIVATIVES BRITISH BIOTECH PHARM (GB) 2000-02-23 EP disclosed
US-5986132-A Synthesis of carboxylic acid derivatives BRITISH BIOTECH PHARMACEUTICALS LTD. (GB) 1999-11-16 US disclosed
WO-1997003966-A1 N-(AMINO ACID) SUBSTITUTED SUCCINIC ACID AMIDE DERIVATIVES AS METALLOPROTEINASE INHIBITORS BRITISH BIOTECH PHARMACEUTICALS LIMITED (GB) 1997-02-06 WO disclosed