SCHEMBL4852169

SCHEMBL4852169

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

nearest known ligand 0.57

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 18/20 0.57
MMP2 P08253 11/20 0.57
MMP3 P08254 9/20 0.57
MMP8 P22894 6/20 0.53
MMP9 P14780 5/20 0.53
MMP7 P09237 4/20 0.53
FCER2 P06734 3/20 0.53
ADAM17 P78536 2/20 0.49
MMP12 P39900 1/20 0.49
MMP13 P45452 1/20 0.49
MMP14 P50281 1/20 0.49

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
SCHEMBL13986872 0.85 MMP1 (0.63) MMP1MMP2MMP3MMP8MMP9
SCHEMBL5886644 0.85 MMP1 (0.63) MMP1MMP2MMP3MMP8MMP9
SCHEMBL7400674 0.81 PSMB5 (0.69) MMP1MMP2MMP3MMP8MMP9
SCHEMBL6414154 0.79 MMP1 (0.67) MMP1MMP2MMP3MMP8MMP9
SCHEMBL7367573 0.79 MMP1 (0.67) MMP1MMP2MMP3MMP8MMP9
SCHEMBL22928874 0.79 REN (0.71) MMP1MMP2MMP3MMP8MMP9
SCHEMBL8510052 0.79 PSMB5 (0.70) MMP1MMP2MMP3MMP8MMP9
SCHEMBL7404473 0.79 MMP1 (0.63) MMP1MMP2MMP3MMP8MMP9
SCHEMBL6414037 0.78 MME (0.74) MMP1MMP2MMP3MMP8MMP9
SCHEMBL7268405 0.78 MME (0.59) MMP2MMP9MMP7MMP12MMP13

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7468359-B2 Compositions comprising oxophosphonate-based metalloproteinase inhibitors YISSUM RESEARCH DEVELPMENT COMPANY OF THE HEBREW UNIVERSITY OF JERUSALEM (US) 2008-12-23 US disclosed
US-20060199787-A1 COMPOSITIONS COMPRISING OXOPHOSPHONATE-BASED METALLOPROTEINASE INHIBITORS YISSUM RESEARCH DEVELOPMENT COMPANY OF THE HEBREW UNIVERSITY OF JERUSALEM (IL) 2006-09-07 US disclosed
US-7101864-B1 Compositions comprising oxophosphonate-based metalloproteinase inhibitors YISSUM RESEARCH DEVELOPMENT COMPANY OF THE HEBREW UNIVERSITY OF JERUSALEM (IL) 2006-09-05 US disclosed
EP-1223945-A1 COMPOSITIONS COMPRISING OXOPHOSPHONATE-BASED METALLOPROTEINASE INHIBITORS YISSUM RESEARCH DEVELOPMENT COMPANY OF THE HEBREW UNIVERSITY OF JERUSALEM (IL) 2002-07-24 EP disclosed
WO-2001026661-A1 COMPOSITIONS COMPRISING OXOPHOSPHONATE-BASED METALLOPROTEINASE INHIBITORS YISSUM RESEARCH DEVELOPMENT COMPANY OF THE HEBREW UNIVERSITY OF JERUSALEM (IL) 2001-04-19 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20060199787-A1 COMPOSITIONS COMPRISING OXOPHOSPHONATE-BASED METALLOPROTEINASE INHIBITORS ENPP1, MMP1, MMP9 MMP1 2/4885MMP2 31/4885MMP3 21/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.