SCHEMBL1108575

SCHEMBL1108575

C[C@@H](NS(=O)(=O)c1ccc(Oc2ccc(F)cc2)cc1)[C@]1(C)NC(=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
MMP13 P45452 10/20 0.40
MMP1 P03956 8/20 0.40
MMP9 P14780 5/20 0.40
MMP2 P08253 4/20 0.40
MMP3 P08254 3/20 0.40
MMP7 P09237 3/20 0.40
ADAMTS4 O75173 2/20 0.40
SOS1 Q07889 1/20 0.40
MMP14 P50281 2/20 0.39
MMP8 P22894 1/20 0.39
BCL2L1 Q07817 1/20 0.39
MCL1 Q07820 1/20 0.39
PTGS1 P23219 1/20 0.38
PTGS2 P35354 1/20 0.38
LMNA P02545 1/20 0.38
HTT P42858 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
CACNA1H O95180 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
SCHEMBL1108547 1.00 FFAR1 (0.41) FFAR1FFAR4MMP13MMP1MMP9
SCHEMBL1108557 0.89 FFAR1 (0.42) FFAR1MMP13MMP1MMP9MMP2
SCHEMBL1108541 0.89 FFAR1 (0.42) FFAR1MMP13MMP1MMP9MMP2
SCHEMBL1108577 0.89 MMP2 (0.44) MMP13MMP1MMP9MMP2MMP3
SCHEMBL1108586 0.89 MMP9 (0.51) FFAR1FFAR4MMP13MMP1MMP9
SCHEMBL1108501 0.89 MMP9 (0.51) FFAR1FFAR4MMP13MMP1MMP9
SCHEMBL1108587 0.89 MMP2 (0.44) MMP13MMP1MMP9MMP2MMP3
SCHEMBL1108545 0.88 PGR (0.41) MMP13MMP1MMP9MMP2MMP3
SCHEMBL1108564 0.88 PGR (0.41) MMP13MMP1MMP9MMP2MMP3
SCHEMBL13127079 0.88 MMP9 (0.40) MMP13MMP1MMP9MMP2MMP3

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 13 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
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-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 4174/4885MMP13 6/4885
US-20080262045-A1 Metalloproteinase Inhibitors MMP9, MMP12, MMP11 FFAR1 2750/4885FFAR4 4174/4885MMP13 6/4885
US-20040138276-A1 Metalloproteinase inhibitors MMP9, MMP11, MMP7 FFAR1 2897/4885FFAR4 4403/4885MMP13 7/4885

“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.