SCHEMBL1108560

SCHEMBL1108560

CS(=O)(=O)C[C@@H]1NC(=O)NC1=O

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.41
GAA P10253 1/20 0.36
ALDH1A1 P00352 2/20 0.31
MEN1 O00255 1/20 0.31
CASP1 P29466 1/20 0.31
KMT2A Q03164 1/20 0.31
ADAMTS5 Q9UNA0 2/20 0.30
MAPT P10636 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
MGAT2 Q10469 1/20 0.30
MMP2 P08253 1/20 0.30
ADAM17 P78536 1/20 0.30
ADAMTS4 O75173 1/20 0.30
HSD17B10 Q99714 1/20 0.30

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
SCHEMBL13995991 1.00 TSHR (0.41) TSHRGAAALDH1A1MEN1CASP1
SCHEMBL13254886 1.00 TSHR (0.41) TSHRGAAALDH1A1MEN1CASP1
SCHEMBL17830362 0.82
SCHEMBL15178979 0.82 NOS1 (0.33)
SCHEMBL191784 0.82
SCHEMBL3453911 0.79 TSHR (0.37) TSHRGAAALDH1A1MEN1CASP1
SCHEMBL941138 0.79 TSHR (0.37) TSHRGAAALDH1A1MEN1CASP1
SCHEMBL942266 0.79 TSHR (0.37) TSHRGAAALDH1A1MEN1CASP1
Formaldehyde SCHEMBL8835715 0.78 TSHR (0.44) TSHRGAAALDH1A1MEN1CASP1
SCHEMBL11352404 0.72 TSHR (0.46) TSHRGAAALDH1A1MEN1CASP1

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 7 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
US-7754750-B2 a -5 substituted 1-H,3-H-imidazolidine-2,4-dione such as 5-(2-{[4-(4'-fluoro[1,1'-biphenyl]-4-yl)-1-piperazinyl]sulfonyl}ethyl)-2,4-imidazolidinedione; protease inhibitors, especially metalloelastase (MMP12) ASTRAZENECA AB (SE) 2010-07-13 US disclosed
US-20080306065-A1 Metalloproteinase Inhibitors ASTRAZENECA AB (SE) 2008-12-11 US disclosed
US-7427631-B2 especially as inhibitors of MMP12 ASTRAZENECA AB (SE) 2008-09-23 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

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-20080306065-A1 Metalloproteinase Inhibitors MMP9, MMP12, MMP14 TSHR 4080/4885GAA 123/4885ALDH1A1 612/4885
US-20100273849-A1 Metalloproteinase Inhibitors MMP9, MMP12, MMP11 TSHR 2145/4885GAA 271/4885ALDH1A1 1381/4885
US-20040138276-A1 Metalloproteinase inhibitors MMP9, MMP11, MMP7 TSHR 2710/4885GAA 296/4885ALDH1A1 1172/4885

“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.