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SCHEMBL7324972

SCHEMBL7324972

COP(=O)(OC)[C@@H](CCN1C(=O)c2cccc3cccc(c23)C1=O)N[C@@H](CC(C)C)C(=O)NC(CCCCNC(=O)OCc1ccccc1)C(=O)NCCNC(=O)OCc1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ MMP1 P03956 3/20 0.45
▸ MMP9 P14780 3/20 0.45
▸ CPB1 P15086 1/20 0.44
▸ CPB2 Q96IY4 1/20 0.44
▸ PTGER4 P35408 3/20 0.44
▸ MMP3 P08254 3/20 0.43
▸ SIRT5 Q9NXA8 1/20 0.42

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
SCHEMBL7321903 0.86 TGM2 (0.41) MMP1MMP9CPB1CPB2MMP3
SCHEMBL7322384 0.81 MMP1 (0.54) MMP1MMP9MMP3
SCHEMBL7356800 0.79 ERAP1 (0.53) MMP9
SCHEMBL7329953 0.78 MMP1 (0.50) MMP1MMP9MMP3
SCHEMBL7363513 0.78 MMP1 (0.51) MMP1MMP9MMP3
SCHEMBL7322837 0.77 MMP1 (0.35) MMP1MMP9MMP3
SCHEMBL6418519 0.77 MMP1 (0.44) MMP1MMP9MMP3
Hydrochloric Acid SCHEMBL7328354 0.76 MMP1 (0.44) MMP1MMP9MMP3
SCHEMBL7322307 0.75 MMP1 (0.48) MMP1MMP9MMP3
SCHEMBL7387789 0.75 MMP1 (0.41) MMP1MMP9MMP3

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