SCHEMBL940743

SCHEMBL940743

CS(=O)(=O)c1ccc(Oc2ccc(Cl)cn2)cc1

nearest known ligand 0.57

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 8/20 0.57
PTGS1 P23219 6/20 0.57
LIPE Q05469 1/20 0.49
CYP11B1 P15538 1/20 0.45
CYP11B2 P19099 1/20 0.45
NFE2L2 Q16236 1/20 0.45
GPR119 Q8TDV5 1/20 0.43
P2RX3 P56373 2/20 0.41
DAGLA Q9Y4D2 1/20 0.41
KDM4E B2RXH2 1/20 0.41
HRH3 Q9Y5N1 1/20 0.41
SCN9A Q15858 1/20 0.40

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
SCHEMBL6808653 0.94 PTGS2 (0.53) PTGS2PTGS1LIPECYP11B1CYP11B2
SCHEMBL10833553 0.91 PTGS2 (0.51) PTGS2PTGS1LIPECYP11B1CYP11B2
SCHEMBL20325535 0.87 LIPE (0.48) PTGS2PTGS1LIPENFE2L2DAGLA
SCHEMBL7994583 0.83 PTGS2 (0.56) PTGS2PTGS1GPR119KDM4E
SCHEMBL19435036 0.81 KDM4E (0.59) PTGS2PTGS1KDM4E
SCHEMBL1477426 0.81 PTGS2 (0.57) PTGS2PTGS1KDM4E
SCHEMBL29504605 0.81 KDM4E (0.59) PTGS2PTGS1KDM4E
SCHEMBL7363201 0.79 PTGS2 (0.56) PTGS2PTGS1CYP11B1CYP11B2
SCHEMBL10833967 0.79 DAGLA (0.44) PTGS2PTGS1LIPEP2RX3DAGLA
SCHEMBL8684262 0.78 LIPE (0.51) LIPEKDM4EHRH3SCN9A

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-20110003853-A1 Metalloproteinase Inhibitors ASTRAZENECA AB (SE) 2011-01-06 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-7625934-B2 Metalloproteinase inhibitors ASTRAZENECA AB (SE) 2009-12-01 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-20080171882-A1 Metalloproteinase Inhibitors ASTRAZENECA AB (SE) 2008-07-17 US disclosed
EP-1370556-B1 METALLOPROTEINASE INHIBITORS ASTRAZENECA AB (SE) 2006-07-19 EP disclosed
EP-1676846-A2 Hydantoin derivatives as MMP inhibitors AstraZeneca AB (SE) 2006-07-05 EP disclosed
US-20040147573-A1 Metalloproteinase inhibitors ASTRAZENECA AB (SE) 2004-07-29 US disclosed
EP-1370536-A1 METALLOPROTEINASE INHIBITORS AstraZeneca AB (SE) 2003-12-17 EP disclosed
EP-1370556-A1 METALLOPROTEINASE INHIBITORS AstraZeneca AB (SE) 2003-12-17 EP disclosed
WO-2002074767-A1 METALLOPROTEINASE INHIBITORS ASTRAZENECA AB (SE) 2002-09-26 WO disclosed
WO-2002074750-A1 METALLOPROTEINASE INHIBITORS ASTRAZENECA AB (SE) 2002-09-26 WO 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 (4 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-20110003853-A1 Metalloproteinase Inhibitors MMP9, MMP12, MMP14 PTGS2 65/4885PTGS1 55/4885LIPE 3434/4885
US-20080306065-A1 Metalloproteinase Inhibitors MMP9, MMP12, MMP14 PTGS2 65/4885PTGS1 55/4885LIPE 3434/4885
US-20080171882-A1 Metalloproteinase Inhibitors MMP9, MMP12, MMP14 PTGS2 65/4885PTGS1 55/4885LIPE 3434/4885
US-20040147573-A1 Metalloproteinase inhibitors MMP12, MMP7, MMP10 PTGS2 686/4885PTGS1 423/4885LIPE 1310/4885

“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.