SCHEMBL1108561

SCHEMBL1108561

Cc1ccc(Oc2ccc(S(=O)(=O)N[C@H](C)[C@@]3(c4ccccc4)NC(=O)NC3=O)cc2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 1/20 0.46
MMP9 P14780 4/20 0.44
MMP13 P45452 3/20 0.44
HTT P42858 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
MMP2 P08253 3/20 0.42
MMP3 P08254 2/20 0.42
ADAMTS4 O75173 2/20 0.42
MMP1 P03956 1/20 0.42
MMP7 P09237 1/20 0.42
CYP2C9 P11712 2/20 0.40
ALDH1A1 P00352 2/20 0.40
CYP1A2 P05177 1/20 0.40
CYP2C19 P33261 1/20 0.40
GFER P55789 1/20 0.38
MMP8 P22894 1/20 0.38
ADAM17 P78536 1/20 0.38
TARS1 P26639 1/20 0.37
KDM4E B2RXH2 1/20 0.37
LMNA P02545 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
SCHEMBL1108590 0.95 MMP9 (0.49) FFAR1MMP9MMP13HTTSMN1; SMN2
SCHEMBL1108583 0.92 PGR (0.46) MMP9MMP13SMN1; SMN2MMP2MMP3
SCHEMBL1108582 0.91 FFAR1 (0.46) FFAR1MMP9MMP13MMP2MMP3
SCHEMBL1108556 0.91 PGR (0.46) FFAR1MMP9MMP13SMN1; SMN2MMP2
SCHEMBL1108579 0.90 MMP9 (0.42) FFAR1MMP9MMP13HTTSMN1; SMN2
SCHEMBL1108558 0.88 MMP9 (0.41) MMP9MMP13HTTSMN1; SMN2MMP2
SCHEMBL1108589 0.88 MMP9 (0.41) MMP9MMP13MMP2MMP3ADAMTS4
SCHEMBL1108588 0.86 ADAMTS4 (0.48) MMP9MMP13HTTSMN1; SMN2MMP2
SCHEMBL1108581 0.83 LIPE (0.41) MMP9MMP13SMN1; SMN2MMP2MMP3
SCHEMBL1108557 0.81 FFAR1 (0.42) FFAR1MMP9MMP13HTTSMN1; SMN2

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 2750/4885MMP9 1/4885MMP13 6/4885
US-20080262045-A1 Metalloproteinase Inhibitors MMP9, MMP12, MMP11 FFAR1 2750/4885MMP9 1/4885MMP13 6/4885
US-20040138276-A1 Metalloproteinase inhibitors MMP9, MMP11, MMP7 FFAR1 2897/4885MMP9 1/4885MMP13 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.