SCHEMBL1108518

SCHEMBL1108518

O=C1NC(=O)[C@H](CNS(=O)(=O)c2ccc(Oc3ccc(Cl)cc3)cc2)N1

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 4/20 0.50
PGR P06401 1/20 0.44
CXCR4 P61073 1/20 0.43
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
MMP2 P08253 5/20 0.41
MMP9 P14780 5/20 0.41
HTT P42858 2/20 0.40
LMNA P02545 1/20 0.40
MMP13 P45452 3/20 0.40
PTGES2 Q9H7Z7 1/20 0.40
MMP3 P08254 1/20 0.40
ALDH1A1 P00352 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
POLB P06746 1/20 0.39

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
SCHEMBL1100869 1.00 MMP1 (0.50) MMP1PGRCXCR4MEN1KMT2A
SCHEMBL1099703 0.93 MMP1 (0.44) MMP1PGRCXCR4MEN1KMT2A
SCHEMBL1108484 0.93 MMP1 (0.44) MMP1PGRCXCR4MEN1KMT2A
SCHEMBL1101192 0.90 LGALS8 (0.41) MMP1PGRCXCR4MEN1KMT2A
SCHEMBL7135320 0.89 ALDH1A1 (0.44) MMP1CXCR4MEN1KMT2AHTT
SCHEMBL1108527 0.89 ALDH1A1 (0.48) MMP1PGRCXCR4MEN1KMT2A
SCHEMBL13126968 0.89 CXCR4 (0.43) MMP1CXCR4MEN1KMT2AMMP2
SCHEMBL1100132 0.89 ALDH1A1 (0.48) MMP1PGRCXCR4MEN1KMT2A
SCHEMBL1100111 0.89 PGR (0.42) MMP1PGRMEN1KMT2AHTT
SCHEMBL1108510 0.89 PGR (0.42) MMP1PGRMEN1KMT2AHTT

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 MMP1 8/4885PGR 3527/4885CXCR4 2779/4885
US-20080262045-A1 Metalloproteinase Inhibitors MMP9, MMP12, MMP11 MMP1 8/4885PGR 3527/4885CXCR4 2779/4885
US-20040138276-A1 Metalloproteinase inhibitors MMP9, MMP11, MMP7 MMP1 11/4885PGR 2805/4885CXCR4 3197/4885

“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.