SCHEMBL5532020

SCHEMBL5532020

CCCCCS(=O)(=O)NO

nearest known ligand 0.54

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CA2 P00918 3/20 0.48
CA1 P00915 2/20 0.48
FAAH O00519 2/20 0.46
RELA Q04206 4/20 0.46
MEN1 O00255 1/20 0.40
ALDH1A1 P00352 1/20 0.40
LMNA P02545 1/20 0.40
MAPT P10636 1/20 0.40
MAPK1 P28482 1/20 0.40
KMT2A Q03164 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
SCHEMBL14670188 0.98 CA2 (0.52) CA2CA1FAAHRELAMEN1
SCHEMBL5893741 0.92
SCHEMBL17898070 0.81
SCHEMBL301013 0.79 FAAH (0.50) CA2CA1FAAHRELA
SCHEMBL4565920 0.79 FAAH (0.50) CA2CA1FAAHRELA
SCHEMBL6501307 0.77 FAAH (0.54) CA2FAAHRELA
SCHEMBL10226704 0.77 FAAH (0.54) CA2FAAHRELA
SCHEMBL1679040 0.77 FAAH (0.48) CA2FAAHRELA
SCHEMBL29166790 0.76 RELA (0.43) CA2CA1FAAHRELAMEN1
SCHEMBL667725 0.76 FAAH (0.43) CA2CA1FAAHRELAMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105820096-A Method for preparing substituted ethyl aryl sulfone 清华大学 2016-08-03 CN disclosed
US-20070275935-A1 Estratriene Derivatives CRYPTOPHARMA PTY LTD (AU) 2007-11-29 US disclosed
EP-1625143-A1 ESTRATRIENE DERIVATIVES Cryptopharma Pty Ltd (AU) 2006-02-15 EP disclosed
WO-2004101595-A1 ESTRATRIENE DERIVATIVES CRYPTOPHARMA PTY LTD (AU) 2004-11-25 WO disclosed
US-20030073682-A1 Novel substituted aryl hydroxamic acids as metalloproteinase inhibitors VOSS MATTHEW E (US) 2003-04-17 US disclosed
US-6365587-B1 FOR THERAPY OF RHEUMATOID ARTHRITIS, OSTEOARTHRITIS, PERIODONTITIS, GINGIVITIS, CORNEAL ULCERATION, MULTIPLE SCLEROSIS, NEURODEGENERATIVE DISEASES, PSORIASIS, AUTOIMMUNE DISEASE, CROHN'S DISEASE, INFLAMMATORY BOWEL DISEASE, OR HIV BRISTOL-MYERS SQUIBB PHARMA COMPANY 2002-04-02 US disclosed
EP-1077978-A1 NOVEL SUBSTITUTED ARYL HYDROXAMIC ACIDS AS METALLOPROTEINASE INHIBITORS Du Pont Pharmaceuticals Company (US) 2001-02-28 EP disclosed
WO-1999058531-A1 NOVEL SUBSTITUTED ARYL HYDROXAMIC ACIDS AS METALLOPROTEINASE INHIBITORS DU PONT PHARMACEUTICALS COMPANY (US) 1999-11-18 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 (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-20070275935-A1 Estratriene Derivatives ESR2, ESRRB, NR3C2 CA2 3030/4885CA1 4457/4885FAAH 2386/4885
US-20030073682-A1 Novel substituted aryl hydroxamic acids as metalloproteinase inhibitors MMP3, MMP10, MMP2 CA2 54/4885CA1 83/4885FAAH 611/4885

“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.