SCHEMBL4882067

SCHEMBL4882067

NCCCC[C@H](NS(=O)(=O)c1cc(Cl)cc(Cl)c1)C(=O)O

nearest known ligand 0.64

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MMP9 P14780 6/20 0.64
MMP2 P08253 6/20 0.64
RAB9A P51151 1/20 0.45
FABP4 P15090 3/20 0.45
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
MMP8 P22894 1/20 0.42
MMP13 P45452 1/20 0.42
ADAMTS4 O75173 1/20 0.42
ITGB3 P05106 3/20 0.42
ITGA2B P08514 3/20 0.42
ADAMTS5 Q9UNA0 1/20 0.41
MMP7 P09237 1/20 0.41
FOLH1 Q04609 1/20 0.40
SLC1A3 P43003 1/20 0.40
SLC1A2 P43004 1/20 0.40
SLC1A1 P43005 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
SCHEMBL4882077 1.00 MMP9 (0.64) MMP9MMP2RAB9AFABP4CA1
SCHEMBL4599857 0.83 MMP2 (0.67) MMP9MMP2RAB9ACA1CA2
SCHEMBL4599862 0.83 MMP2 (0.67) MMP9MMP2RAB9ACA1CA2
SCHEMBL6562692 0.82 MMP9 (0.87) MMP9MMP2MMP8MMP13ADAMTS4
SCHEMBL6562688 0.82 MMP9 (0.87) MMP9MMP2MMP8MMP13ADAMTS4
SCHEMBL4599870 0.80 MMP2 (0.56) MMP9MMP2RAB9ACA1CA2
SCHEMBL4599874 0.80 MMP2 (0.56) MMP9MMP2RAB9ACA1CA2
SCHEMBL10585071 0.78 MMP9 (0.76) MMP9MMP2CA1CA2MMP8
SCHEMBL457772 0.78 MMP9 (0.76) MMP9MMP2CA1CA2MMP8
SCHEMBL8001084 0.78 MMP9 (0.76) MMP9MMP2CA1CA2MMP8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080171783-A1 COMPOSITIONS AND METHODS FOR TREATING HYPERPROLIFERATIVE DISEASE MIGENIX INC. (CA) 2008-07-17 US disclosed
US-20070021434-A1 NON-NUCLEOSIDE ANTI-HEPACIVIRUS AGENTS AND USES THEREOF MIGENIX INC. (CA) 2007-01-25 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 (2 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-20070021434-A1 NON-NUCLEOSIDE ANTI-HEPACIVIRUS AGENTS AND USES THEREOF HAVCR2, ADAR, NSUN2 MMP9 1398/4885MMP2 1319/4885RAB9A 649/4885
US-20080171783-A1 COMPOSITIONS AND METHODS FOR TREATING HYPERPROLIFERATIVE DISEASE POLQ, POLI, POLH MMP9 1098/4885MMP2 745/4885RAB9A 2724/4885

“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.