SCHEMBL877350

SCHEMBL877350

O=C(O)C(CCn1nnc2cccc(Cl)c2c1=O)SCc1ccc(-c2ccc(Cl)cc2)cc1

nearest known ligand 0.43

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 9/20 0.43
MMP3 P08254 9/20 0.43
MMP9 P14780 9/20 0.43
MMP13 P45452 9/20 0.43
MMP1 P03956 5/20 0.43
GPR139 Q6DWJ6 5/20 0.37
KMT2A Q03164 2/20 0.35
TDP1 Q9NUW8 1/20 0.34
PTGDR2 Q9Y5Y4 1/20 0.34

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
SCHEMBL877725 0.87 MMP2 (0.57) MMP2MMP3MMP9MMP13MMP1
SCHEMBL874804 0.80 MMP2 (0.44) MMP2MMP3MMP9MMP13MMP1
SCHEMBL875125 0.80 MMP2 (0.44) MMP2MMP3MMP9MMP13MMP1
SCHEMBL878187 0.80 MMP2 (0.42) MMP2MMP3MMP9MMP13MMP1
SCHEMBL877491 0.80 MMP2 (0.46) MMP2MMP3MMP9MMP13MMP1
SCHEMBL874782 0.79 MMP2 (0.49) MMP2MMP3MMP9MMP13MMP1
SCHEMBL15733014 0.78 MMP2 (0.42) MMP2MMP3MMP9MMP13MMP1
SCHEMBL873727 0.75 MMP2 (0.40) MMP2MMP3MMP9MMP13MMP1
SCHEMBL877149 0.74 MMP2 (0.49) MMP2MMP3MMP9MMP13MMP1
SCHEMBL877541 0.74 MMP2 (0.53) MMP2MMP3MMP9MMP13MMP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140148459-A1 MATRIX METALLOPROTEINASE INHIBITORS RANBAXY LABORATORIES LIMITED (IN) 2014-05-29 US claimed
US-20140148459-A1 MATRIX METALLOPROTEINASE INHIBITORS RANBAXY LABORATORIES LIMITED (IN) 2014-05-29 US disclosed
EP-2619185-A1 MATRIX METALLOPROTEINASE INHIBITORS Ranbaxy Laboratories Limited (IN) 2013-07-31 EP disclosed
WO-2012038942-A1 MATRIX METALLOPROTEINASE INHIBITORS RANBAXY LABORATORIES LIMITED (IN) 2012-03-29 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 (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-20140148459-A1 MATRIX METALLOPROTEINASE INHIBITORS MMP9, MMP12, MMP10 MMP2 17/4885MMP3 4/4885MMP9 1/4885

“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.