SCHEMBL7320159

SCHEMBL7320159

CNC(=O)C(Cc1ccccc1)NC(=O)[C@H](CC(C)C)N[C@H](CCc1ccccc1)P(=O)(OCc1ccccc1)OCc1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 14/20 0.53
MMP3 P08254 8/20 0.53
MMP2 P08253 7/20 0.53
MMP9 P14780 4/20 0.49
MMP8 P22894 3/20 0.49
MMP7 P09237 2/20 0.49
FCER2 P06734 1/20 0.49
MMP12 P39900 1/20 0.48
MMP13 P45452 1/20 0.48

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
SCHEMBL7324102 0.91 MMP1 (0.47) MMP1MMP3MMP2MMP9MMP8
SCHEMBL6412324 0.88 MMP1 (0.56) MMP1MMP3MMP2MMP9MMP8
SCHEMBL6412335 0.88 MMP1 (0.56) MMP1MMP3MMP2MMP9MMP8
SCHEMBL7305651 0.87 MMP3 (0.52) MMP1MMP3
SCHEMBL7309259 0.83 CTSL (0.46) MMP1MMP3MMP2
SCHEMBL7329474 0.83 CTSL (0.46) MMP1MMP3MMP2
SCHEMBL7309270 0.83 CTSL (0.46) MMP1MMP3MMP2
SCHEMBL7323526 0.83 MMP1 (0.53) MMP1MMP3MMP2MMP9MMP8
SCHEMBL7323533 0.83 MMP1 (0.53) MMP1MMP3MMP2MMP9MMP8
SCHEMBL7317922 0.81 MMP1 (0.47) MMP1MMP3

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