SCHEMBL3483960

SCHEMBL3483960

O=C(O)NS(=O)(=O)c1ccc(-c2ccc(OCCCCl)c(OCCCCl)c2)s1

nearest known ligand 0.37

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MMP13 P45452 11/20 0.37
MMP2 P08253 3/20 0.36
MMP9 P14780 2/20 0.36
ADAMTS5 Q9UNA0 4/20 0.34
MMP1 P03956 3/20 0.34
MMP14 P50281 1/20 0.34
ADAM17 P78536 1/20 0.34
ACLY P53396 1/20 0.34
NLRP3 Q96P20 1/20 0.33
MMP3 P08254 1/20 0.33
FFAR1 O14842 1/20 0.33
FFAR4 Q5NUL3 1/20 0.33

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
SCHEMBL3483836 0.83 MCL1 (0.34) MMP2MMP9NLRP3
SCHEMBL3480263 0.81 MAPT (0.34) MMP13MMP2MMP9
SCHEMBL3480804 0.81 CA2 (0.41)
SCHEMBL3946184 0.80 MMP13 (0.35) MMP13MMP2MMP9MMP1MMP14
SCHEMBL3483815 0.79 MCL1 (0.32) MMP13MMP2MMP9NLRP3
SCHEMBL3480581 0.78 S1PR1 (0.34) MMP13MMP2MMP9MMP1
SCHEMBL3480579 0.76 MAPT (0.34) MMP13MMP2MMP9MMP1MMP14
SCHEMBL3480770 0.74 FBP1 (0.36)
SCHEMBL3480524 0.73 LMNA (0.33)
SCHEMBL3480519 0.73 LMNA (0.33)

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2049200-B1 NOVEL INHIBITORS OF BETA-LACTAMASE METHYLGENE INC (CA) 2015-04-29 EP disclosed
US-8440643-B2 Inhibitors of beta-lactamase METHYLGENE INC. (CA) 2013-05-14 US disclosed
US-20100279983-A1 NOVEL INHIBITORS OF BETA-LACTAMASE METHYLGENE INC. 2010-11-04 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 (1 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-20100279983-A1 NOVEL INHIBITORS OF BETA-LACTAMASE MGAM, MGAM2, PGLS MMP13 1499/4885MMP2 152/4885MMP9 66/4885

“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.