SCHEMBL7374189

SCHEMBL7374189

CC(=O)N1CCC[C@H]1C(=O)N[C@@H](C)C(=O)NCC[P@@](=O)(O)CN(C(=O)CCCc1ccccc1)[C@H]([C]=O)CC(C)C

nearest known ligand 0.52

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MMP3 P08254 10/20 0.52
MMP2 P08253 3/20 0.47
MMP1 P03956 3/20 0.47
CPA1 P15085 1/20 0.44
CPA2 P48052 1/20 0.44
CPA4 Q9UI42 1/20 0.44
PLK1 P53350 2/20 0.39
PLK3 Q9H4B4 1/20 0.39
PLK2 Q9NYY3 1/20 0.39
FKBP1A P62942 2/20 0.38

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
SCHEMBL6416214 0.88 MMP3 (0.57) MMP3MMP2MMP1CPA1CPA2
SCHEMBL6416221 0.88 MMP3 (0.57) MMP3MMP2MMP1CPA1CPA2
SCHEMBL8343741 0.86 MMP3 (0.47) MMP3MMP2MMP1CPA1CPA2
SCHEMBL7391702 0.77 MMP3 (0.64) MMP3MMP2MMP1CPA1CPA2
SCHEMBL8858202 0.74 MMP3 (0.54) MMP3MMP2MMP1CPA1CPA2
SCHEMBL7401165 0.73 MMP3 (0.58) MMP3MMP2MMP1CPA1CPA2
SCHEMBL7399623 0.73 MMP3 (0.60) MMP3MMP2MMP1CPA1CPA2
SCHEMBL7401167 0.73 MMP3 (0.58) MMP3MMP2MMP1CPA1CPA2
SCHEMBL7643941 0.73 MMP3 (0.59) MMP3MMP2MMP1FKBP1A
SCHEMBL7401524 0.72 MMP3 (0.66) MMP3MMP2MMP1FKBP1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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-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
EP-0623143-A1 SUBSTITUTED PHOSPHINIC ACID-CONTAINING PEPTIDYL DERIVATIVES AS ANTIDEGENERATIVE AGENTS MERCK & CO. INC. (US) 1994-11-09 EP disclosed
WO-1993014112-A1 SUBSTITUTED PHOSPHINIC ACID-CONTAINING PEPTIDYL DERIVATIVES AS ANTIDEGENERATIVE AGENTS MERCK & CO., INC. (US) 1993-07-22 WO disclosed