SCHEMBL1108533

SCHEMBL1108533

C[C@@H](NS(=O)(=O)c1ccc(Oc2ccc(F)cc2)cc1)[C@@H]1NC(=O)NC1=O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 1/20 0.41
FFAR4 Q5NUL3 1/20 0.41
MMP1 P03956 10/20 0.40
MMP13 P45452 10/20 0.40
MMP9 P14780 7/20 0.40
MMP2 P08253 6/20 0.40
SOS1 Q07889 1/20 0.40
CACNA1H O95180 1/20 0.39
CACNA1B Q00975 1/20 0.39
LMNA P02545 1/20 0.38
HTT P42858 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
MMP3 P08254 5/20 0.38
MMP7 P09237 3/20 0.38
ADAMTS4 O75173 2/20 0.37
MMP8 P22894 3/20 0.37
MMP14 P50281 2/20 0.37
BCL2L1 Q07817 1/20 0.37
MCL1 Q07820 1/20 0.37
CA1 P00915 1/20 0.36

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
SCHEMBL1108539 0.89 FFAR1 (0.42) FFAR1MMP1MMP13MMP9MMP2
SCHEMBL1108567 0.89 MMP2 (0.43) MMP1MMP13MMP9MMP2LMNA
SCHEMBL1108540 0.89 PGR (0.42) MMP1MMP13MMP9MMP2LMNA
SCHEMBL1108570 0.89 MMP9 (0.51) FFAR1FFAR4MMP1MMP13MMP9
SCHEMBL1108481 0.89 CACNA1H (0.43) MMP1MMP13MMP9MMP2CACNA1H
SCHEMBL1108478 0.88 MMP1 (0.41) MMP1MMP13MMP9MMP2LMNA
SCHEMBL1108534 0.85 CACNA1H (0.43) MMP1MMP13MMP9MMP2CACNA1H
SCHEMBL7138393 0.85 MMP9 (0.37) FFAR4MMP1MMP13MMP9MMP2
SCHEMBL13500326 0.81 ADAMTS4 (0.47) MMP1MMP13MMP9MMP2LMNA
SCHEMBL1100466 0.80 ALDH1A1 (0.38) MMP1SMN1; SMN2ADAMTS4

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 12 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-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
US-20100273849-A1 Metalloproteinase Inhibitors ASTRAZENECA AB (SE) 2010-10-28 US disclosed
US-7666892-B2 Metalloproteinase inhibitors ASTRAZENECA AB (SE) 2010-02-23 US 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-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-7368465-B2 Respiratory system disorders; antiarthritic agents; anticancer agents; bone disorders ASTRAZENECA AB (SE) 2008-05-06 US disclosed
US-20040138276-A1 Metalloproteinase inhibitors ASTRAZENECA AB (SE) 2004-07-15 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 (3 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 FFAR1 2750/4885FFAR4 4174/4885MMP1 8/4885
US-20080262045-A1 Metalloproteinase Inhibitors MMP9, MMP12, MMP11 FFAR1 2750/4885FFAR4 4174/4885MMP1 8/4885
US-20040138276-A1 Metalloproteinase inhibitors MMP9, MMP11, MMP7 FFAR1 2897/4885FFAR4 4403/4885MMP1 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.