SCHEMBL942364

SCHEMBL942364

C[C@@H]1C(=O)NC(=O)N1CS(=O)(=O)c1ccc(Oc2ccc(Cl)cn2)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 2/20 0.39
PTGS2 P35354 2/20 0.39
MMP2 P08253 2/20 0.38
MMP9 P14780 2/20 0.38
LIPE Q05469 1/20 0.37
CYP3A4 P08684 1/20 0.36
MMP1 P03956 2/20 0.34
DAGLA Q9Y4D2 1/20 0.34
P2RX3 P56373 4/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
LTA4H P09960 1/20 0.34
SCN9A Q15858 2/20 0.33
NFE2L2 Q16236 1/20 0.33
EGLN1 Q9GZT9 1/20 0.33
KDM4E B2RXH2 1/20 0.33
USP2 O75604 1/20 0.33
POLB P06746 1/20 0.33
HPGD P15428 1/20 0.33
ALOX15 P16050 1/20 0.33
TSHR P16473 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
SCHEMBL942366 1.00 PTGS1 (0.39) PTGS1PTGS2MMP2MMP9LIPE
SCHEMBL942365 0.72 MMP13 (0.45) PTGS1PTGS2MMP2MMP9LIPE
SCHEMBL940743 0.71 PTGS2 (0.57) PTGS1PTGS2LIPEDAGLAP2RX3
SCHEMBL20325535 0.71 LIPE (0.48) PTGS1PTGS2MMP2LIPEMMP1
SCHEMBL1100466 0.69 ALDH1A1 (0.38) PTGS1PTGS2LIPECYP3A4MMP1
SCHEMBL1108568 0.69 LIPE (0.40) PTGS1PTGS2MMP2MMP9LIPE
SCHEMBL1108574 0.69 ALDH1A1 (0.38) PTGS1PTGS2LIPECYP3A4MMP1
SCHEMBL1100372 0.69 LIPE (0.40) PTGS1PTGS2MMP2MMP9LIPE
SCHEMBL10833967 0.69 DAGLA (0.44) PTGS1PTGS2MMP2LIPEMMP1
SCHEMBL1108520 0.69 USP30 (0.40) PTGS1PTGS2MMP2LIPECYP3A4

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 10 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
US-20040127528-A1 Metalloproteinase inhibitors ASTRAZENECA AB (SE) 2004-07-01 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 (5 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 PTGS1 55/4885PTGS2 65/4885MMP2 15/4885
US-20080306065-A1 Metalloproteinase Inhibitors MMP9, MMP12, MMP14 PTGS1 55/4885PTGS2 65/4885MMP2 15/4885
US-20080171882-A1 Metalloproteinase Inhibitors MMP9, MMP12, MMP14 PTGS1 55/4885PTGS2 65/4885MMP2 15/4885
US-20040127528-A1 Metalloproteinase inhibitors MMP9, MMP10, MMP3 PTGS1 137/4885PTGS2 128/4885MMP2 11/4885
US-20040147573-A1 Metalloproteinase inhibitors MMP12, MMP7, MMP10 PTGS1 423/4885PTGS2 686/4885MMP2 11/4885

“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.