SCHEMBL7330965

SCHEMBL7330965

CNC(=O)[C@H](Cc1ccccc1)NC(=O)C(N)CC(C)C

nearest known ligand 0.66

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 16/20 0.66
MMP2 P08253 11/20 0.66
MMP3 P08254 9/20 0.66
MMP8 P22894 6/20 0.65
MMP9 P14780 5/20 0.65
MMP7 P09237 4/20 0.65
FCER2 P06734 4/20 0.65
ADAM17 P78536 2/20 0.58
MMP12 P39900 1/20 0.58
MMP13 P45452 1/20 0.58
MMP14 P50281 1/20 0.58

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
SCHEMBL28221967 1.00 MMP1 (0.66) MMP1MMP2MMP3MMP8MMP9
SCHEMBL7330972 1.00 MMP1 (0.66) MMP1MMP2MMP3MMP8MMP9
SCHEMBL10036418 0.92 MMP1 (0.58) MMP1MMP2MMP3MMP8MMP9
SCHEMBL30051537 0.89 LTA4H (0.61) MMP2MMP9MMP7MMP12MMP13
SCHEMBL2185269 0.89 LTA4H (0.64) MMP2MMP9MMP7MMP12MMP13
SCHEMBL28860411 0.89 LTA4H (0.64) MMP2MMP9MMP7MMP12MMP13
SCHEMBL1864709 0.89 LTA4H (0.64) MMP2MMP9MMP7MMP12MMP13
SCHEMBL27517670 0.89 LTA4H (0.64) MMP2MMP9MMP7MMP12MMP13
SCHEMBL29519583 0.89 LTA4H (0.64) MMP2MMP9MMP7MMP12MMP13
SCHEMBL20669159 0.89 MMP1 (0.61) MMP1MMP2MMP3MMP8MMP9

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-0612324-A1 PHOSPHONOPEPTIDES WITH COLLAGENASE INHIBITING ACTIVITY SMITHKLINE BEECHAM PLC (GB) 1994-08-31 EP disclosed
WO-1993009136-A1 PHOSPHONOPEPTIDES WITH COLLAGENASE INHIBITING ACTIVITY SMITHKLINE BEECHAM PLC (GB) 1993-05-13 WO disclosed