SCHEMBL7079277

SCHEMBL7079277

CC(C)(C)ONC(=O)C(CCCc1ccccc1)C(OC1CCCC1)S(=O)(=O)c1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 14/20 0.40
MMP3 P08254 10/20 0.40
PDE4A P27815 6/20 0.40
PDE4B Q07343 6/20 0.40
PDE4C Q08493 6/20 0.40
PDE4D Q08499 6/20 0.40
MMP1 P03956 6/20 0.39
FKBP1A P62942 3/20 0.38
ADAM17 P78536 1/20 0.36

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
SCHEMBL7512119 0.84 FKBP1A (0.41) MMP2MMP3PDE4APDE4BPDE4C
SCHEMBL7080521 0.82 MMP1 (0.41) MMP2MMP3PDE4APDE4BPDE4C
SCHEMBL7079276 0.75 MMP2 (0.52) MMP2MMP3PDE4APDE4BPDE4C
SCHEMBL7073432 0.68 MMP2 (0.60) MMP2MMP3PDE4APDE4BPDE4C
SCHEMBL7079189 0.66 MMP1 (0.44) MMP2MMP3PDE4APDE4BPDE4C
SCHEMBL8002828 0.65 MMP2 (0.57) MMP2MMP3PDE4APDE4BPDE4C
SCHEMBL7080932 0.65 MMP2 (0.57) MMP2MMP3PDE4APDE4BPDE4C
SCHEMBL4290067 0.64 MMP2 (0.41) MMP2MMP3MMP1FKBP1A
SCHEMBL7074155 0.64 MMP2 (0.62) MMP2MMP3PDE4APDE4BPDE4C
SCHEMBL10419532 0.64 PDE4A (0.53) MMP2MMP3PDE4APDE4BPDE4C

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 2/4885MMP3 5/4885PDE4A 3341/4885

“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.