SCHEMBL6838831

SCHEMBL6838831

CCCCCCCCCCCCCCC(CNCCCCC(NS(=O)(=O)c1ccc(-c2ccc(Br)cc2)cc1)C(=O)O)Oc1ccc(Cl)cc1

nearest known ligand 0.57

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 19/20 0.57
MMP9 P14780 16/20 0.57
MMP1 P03956 8/20 0.50
MMP3 P08254 8/20 0.50
MMP13 P45452 8/20 0.50
MMP7 P09237 7/20 0.50
MMP8 P22894 4/20 0.50
MMP12 P39900 4/20 0.50
MMP14 P50281 4/20 0.50
ADAMTS5 Q9UNA0 1/20 0.43

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
SCHEMBL8839753 0.78 MMP2 (0.58) MMP2MMP9MMP1MMP3MMP13
SCHEMBL8839750 0.78 MMP2 (0.58) MMP2MMP9MMP1MMP3MMP13
SCHEMBL6415418 0.77 MMP2 (0.63) MMP2MMP9MMP1MMP3MMP13
SCHEMBL6413229 0.77 MMP2 (0.57) MMP2MMP9MMP1MMP3MMP13
SCHEMBL6418837 0.76 MMP2 (0.66) MMP2MMP9MMP1MMP3MMP13
SCHEMBL6415170 0.75 MMP2 (0.69) MMP2MMP9MMP1MMP3MMP13
SCHEMBL6419176 0.74 MMP2 (0.60) MMP2MMP9MMP1MMP3MMP13
SCHEMBL8839572 0.74 MMP2 (0.57) MMP2MMP9MMP1MMP3MMP13
SCHEMBL8839281 0.74 MMP2 (0.57) MMP2MMP9MMP1MMP3MMP13
SCHEMBL8839291 0.74 MMP2 (0.57) MMP2MMP9MMP1MMP3MMP13

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040176393-A1 Statin-MMP inhibitor combinations NEWTON ROGER SCHOFIELD (US) 2004-09-09 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 (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-20040176393-A1 Statin-MMP inhibitor combinations MMP9, TIMP3, MMP3 MMP2 19/4885MMP9 1/4885MMP1 20/4885

“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.