Ethane

Ethane

SCHEMBL4974014

CC.CC(C)(C)S(N)(=O)=O

nearest known ligand 0.44

Full drug profile on Sugi Atlas →

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CA1 P00915 5/20 0.44
CA2 P00918 4/20 0.44
CA7 P43166 3/20 0.44
CA13 Q8N1Q1 1/20 0.44
CA4 P22748 2/20 0.39
CA6 P23280 2/20 0.39
CA5A P35218 2/20 0.39
CA9 Q16790 2/20 0.39
CA5B Q9Y2D0 2/20 0.39
TSHR P16473 1/20 0.33
NT5E P21589 1/20 0.33

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
SCHEMBL26864 0.96
SCHEMBL28241435 0.96 CA1 (0.47) CA1CA2CA7CA13CA4
SCHEMBL28300896 0.92
SCHEMBL30656011 0.92 CA1 (0.44) CA1CA2CA7CA13CA4
Hydrochloric Acid SCHEMBL10876127 0.92
Sulfamide SCHEMBL25410596 0.92 CA1 (0.50) CA1CA2CA7CA13CA4
SCHEMBL28257688 0.92
Methane SCHEMBL29135581 0.88 CA1 (0.41) CA1CA2CA7CA13CA4
Benzene SCHEMBL9326550 0.85 CA1 (0.40) CA1CA2CA7CA13CA4
Butane SCHEMBL27918070 0.82 CA1 (0.42) CA1CA2CA7CA13CA4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1745032-B1 CXCR1 and CXCR2 chemokine antagonists MERCK SHARP & DOHME (US) 2013-07-31 EP disclosed
US-7326729-B2 CXCR1 and CXCR2 chemokine antagonists SCHERING CORPORATION (US) 2008-02-05 US disclosed
US-20070248594-A1 CXCR1 AND CXCR2 CHEMOKINE ANTAGONISTS SCHERING CORPORATION 2007-10-25 US disclosed
EP-1745032-A2 CXCR1 AND CXCR2 CHEMOKINE ANTAGONISTS Schering Cooperation (US) 2007-01-24 EP disclosed
US-20060014794-A1 CXCR1 and CXCR2 chemokine antagonists SCHERING CORPORATION 2006-01-19 US disclosed
WO-2005113534-A2 CXCR1 AND CXCR2 CHEMOKINE ANTAGONISTS SCHERING CORPORATION (US) 2005-12-01 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-20070248594-A1 CXCR1 AND CXCR2 CHEMOKINE ANTAGONISTS CXCR1, CXCR2, CXCR5 CA1 2319/4885CA2 2801/4885CA7 2490/4885
US-20060014794-A1 CXCR1 and CXCR2 chemokine antagonists CXCR1, CXCR2, CXCR5 CA1 2319/4885CA2 2801/4885CA7 2490/4885

“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.