SCHEMBL1100591

SCHEMBL1100591

C[C@@]1(CS(=O)(=O)Nc2ccc(Oc3ccc(Cl)cc3)cc2)NC(=O)NC1=O

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MMP13 P45452 13/20 0.51
MMP12 P39900 6/20 0.51
MMP2 P08253 2/20 0.48
ADAMTS5 Q9UNA0 2/20 0.48
ADAMTS4 O75173 1/20 0.48
MMP3 P08254 1/20 0.48
PGR P06401 2/20 0.42
MGAT1 P26572 1/20 0.41
MGAT3 Q09327 1/20 0.41
MGAT2 Q10469 1/20 0.41
MMP14 P50281 3/20 0.40
SMN1; SMN2 Q16637 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
BRD4 O60885 1/20 0.37
BRDT Q58F21 1/20 0.37

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
SCHEMBL1100587 1.00 MMP13 (0.51) MMP13MMP12MMP2ADAMTS5ADAMTS4
SCHEMBL6210006 1.00 MMP13 (0.51) MMP13MMP12MMP2ADAMTS5ADAMTS4
SCHEMBL1099762 0.76 ALDH1A1 (0.48) MMP13PGRMGAT1MGAT3MGAT2
SCHEMBL1099764 0.76 ALDH1A1 (0.48) MMP13PGRMGAT1MGAT3MGAT2
SCHEMBL6208964 0.74 PGR (0.41) MMP13MMP2MMP3PGRMGAT1
SCHEMBL6210997 0.74 ADAM17 (0.43) MMP13MMP12ADAMTS4MMP14
SCHEMBL1100647 0.74 HPGD (0.58) MMP2ADAMTS5PGRSMN1; SMN2NPSR1
SCHEMBL6727429 0.73 MMP13 (0.44) MMP13MMP12MMP2MMP3PGR
SCHEMBL6210085 0.70 ADAM17 (0.70) MMP13MMP2
SCHEMBL942365 0.70 MMP13 (0.45) MMP13MMP12MMP2ADAMTS5ADAMTS4

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
US-8153673-B2 Metalloproteinase inhibitors ASTRAZENECA AB (SE) 2012-04-10 US disclosed
US-20100273849-A1 Metalloproteinase Inhibitors ASTRAZENECA AB (SE) 2010-10-28 US disclosed
EP-1370537-B1 METALLOPROTEINASE INHIBITORS ASTRAZENECA AB (SE) 2010-10-13 EP disclosed
US-7666892-B2 Metalloproteinase inhibitors ASTRAZENECA AB (SE) 2010-02-23 US disclosed
US-20080262045-A1 Metalloproteinase Inhibitors ASTRAZENECA AB (SE) 2008-10-23 US disclosed
US-7368465-B2 Respiratory system disorders; antiarthritic agents; anticancer agents; bone disorders ASTRAZENECA AB (SE) 2008-05-06 US disclosed
US-20040147573-A1 Metalloproteinase inhibitors ASTRAZENECA AB (SE) 2004-07-29 US disclosed
US-20040138276-A1 Metalloproteinase inhibitors ASTRAZENECA AB (SE) 2004-07-15 US 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 (4 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-20100273849-A1 Metalloproteinase Inhibitors MMP9, MMP12, MMP11 MMP13 6/4885MMP12 2/4885MMP2 9/4885
US-20080262045-A1 Metalloproteinase Inhibitors MMP9, MMP12, MMP11 MMP13 6/4885MMP12 2/4885MMP2 9/4885
US-20040138276-A1 Metalloproteinase inhibitors MMP9, MMP11, MMP7 MMP13 7/4885MMP12 6/4885MMP2 8/4885
US-20040147573-A1 Metalloproteinase inhibitors MMP12, MMP7, MMP10 MMP13 19/4885MMP12 1/4885MMP2 11/4885

“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.