SCHEMBL7078718

SCHEMBL7078718

COc1cccc(S(=O)(=O)CC(CCCc2ccccc2)C(=O)O)c1

nearest known ligand 0.60

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 8/20 0.60
MMP1 P03956 7/20 0.60
MMP3 P08254 7/20 0.60
MMP9 P14780 6/20 0.60
MMP8 P22894 6/20 0.60
HSD11B1 P28845 1/20 0.46
PDE4A P27815 2/20 0.46
PDE4B Q07343 2/20 0.46
PDE4C Q08493 2/20 0.46
PDE4D Q08499 2/20 0.46
TAS2R14 Q9NYV8 2/20 0.45
GRIK1 P39086 1/20 0.44
KMT2A Q03164 1/20 0.44
PGR P06401 1/20 0.44
RAB9A P51151 1/20 0.43
AKR1C3 P42330 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
SCHEMBL7077710 0.87 MMP2 (0.70) MMP2MMP1MMP3MMP9MMP8
SCHEMBL7075141 0.84 MMP2 (0.80) MMP2MMP1MMP3MMP9MMP8
SCHEMBL1858307 0.81 MTNR1A (0.53) GRIK1KMT2ARAB9A
SCHEMBL27517321 0.79 MMP2 (0.81) MMP2MMP1MMP3MMP9MMP8
SCHEMBL7073281 0.79 MMP2 (0.58) MMP2MMP1MMP3MMP9MMP8
SCHEMBL7075404 0.78 MMP2 (0.67) MMP2MMP1MMP3MMP9MMP8
SCHEMBL7431052 0.78 MMP2 (0.58) MMP2MMP1MMP3MMP9MMP8
SCHEMBL7534733 0.78 MMP2 (0.58) MMP2MMP1MMP3MMP9MMP8
SCHEMBL7078224 0.77 MMP2 (0.77) MMP2MMP1MMP3MMP9MMP8
SCHEMBL7075406 0.77 MMP2 (0.77) MMP2MMP1MMP3MMP9MMP8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030207889-A1 Hydroxamic and carboxylic acid derivatives having MMP and TNF inhibitory activity OWEN DAVID ALAN (GB) 2003-11-06 US disclosed
US-6566384-B1 For therapy of cancer, inflammation and inflammatory diseases, tissue degeneration, periodontal disease, ophthalmological disease, dermatological disorders, fever, cardiovascular effects, haemorrhage, coagulation and acute phase response DARWIN DISCOVERY LTD. (GB) 2003-05-20 US disclosed
US-6118001-A ANTICANCER AGENT; ANTIARTHRITIC AGENT DARWIN DISCOVERY, LTD. (GB) 2000-09-12 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-20030207889-A1 Hydroxamic and carboxylic acid derivatives having MMP and TNF inhibitory activity MMP13, MMP2, MMP9 MMP2 2/4885MMP1 16/4885MMP3 5/4885

“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.