SCHEMBL7364027

SCHEMBL7364027

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

nearest known ligand 0.56

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MME P08473 1/20 0.56
ECE1 P42892 1/20 0.56
CAPN1 P07384 2/20 0.53
MMP3 P08254 3/20 0.53
ACE2 Q9BYF1 1/20 0.52
MMP1 P03956 2/20 0.52
MMP2 P08253 1/20 0.52
CTSL P07711 1/20 0.52
CTSK P43235 1/20 0.52
HTRA1 Q92743 1/20 0.50

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
SCHEMBL6416269 0.87 MMP3 (0.52) MMEECE1CAPN1MMP3MMP1
SCHEMBL6416283 0.87 MMP3 (0.52) MMEECE1CAPN1MMP3MMP1
SCHEMBL8014485 0.84 CAPN1 (0.72) CAPN1MMP3MMP1MMP2CTSL
SCHEMBL6257513 0.81 MMP1 (0.58) MMP3MMP1MMP2
SCHEMBL7328781 0.80 CAPN1 (0.50) CAPN1MMP3MMP1MMP2
SCHEMBL9348204 0.79 ECE1 (0.51) MMEECE1CAPN1ACE2CTSL
SCHEMBL7367269 0.78 MMP1 (0.51) MMP3MMP1MMP2
SCHEMBL15397862 0.78 ACE2 (0.71) MMEECE1ACE2CTSLCTSK
SCHEMBL21219280 0.77 CAPN1 (0.74) MMEECE1CAPN1CTSLCTSK
SCHEMBL21219351 0.77 CAPN1 (0.74) MMEECE1CAPN1CTSLCTSK

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 10 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 claimed
EP-1063991-A1 STATIN-MATRIX METALLOPROTEINASE INHIBITOR COMBINATIONS WARNER-LAMBERT COMPANY LLC (US) 2001-01-03 EP disclosed
EP-1047450-A1 ACE INHIBITOR-MMP INHIBITOR COMBINATIONS WARNER-LAMBERT COMPANY (US) 2000-11-02 EP disclosed
EP-1028716-A1 METHOD FOR TREATING AND PREVENTING HEART FAILURE AND VENTRICULAR DILATATION WARNER-LAMBERT COMPANY (US) 2000-08-23 EP disclosed
EP-0946166-A1 USE OF MATRIX METALLOPROTEINASE INHIBITORS FOR TREATING NEUROLOGICAL DISORDERS AND PROMOTING WOUND HEALING WARNER-LAMBERT COMPANY (US) 1999-10-06 EP disclosed
WO-1999047138-A1 STATIN-MATRIX METALLOPROTEINASE INHIBITOR COMBINATIONS WARNER-LAMBERT COMPANY (US) 1999-09-23 WO disclosed
WO-1999032150-A1 ACE INHIBITOR-MMP INHIBITOR COMBINATIONS WARNER-LAMBERT COMPANY (US) 1999-07-01 WO disclosed
WO-1998026773-A1 USE OF MATRIX METALLOPROTEINASE INHIBITORS FOR TREATING NEUROLOGICAL DISORDERS AND PROMOTING WOUND HEALING WARNER-LAMBERT COMPANY (US) 1998-06-25 WO disclosed
WO-1998025597-A2 METHOD FOR TREATING AND PREVENTING HEART FAILURE AND VENTRICULAR DILATATION WARNER-LAMBERT COMPANY (US) 1998-06-18 WO disclosed
EP-0612324-A1 PHOSPHONOPEPTIDES WITH COLLAGENASE INHIBITING ACTIVITY SMITHKLINE BEECHAM PLC (GB) 1994-08-31 EP disclosed