Ether

Ether

SCHEMBL2714949

CCOCC.CS(=O)(=O)Cl

nearest known ligand 0.36

Full drug profile on Sugi Atlas →

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
ALDH1A1 P00352 3/20 0.32
TSHR P16473 3/20 0.32
USP2 O75604 2/20 0.32
KDM4E B2RXH2 2/20 0.31
CYP3A4 P08684 1/20 0.31
LMNA P02545 1/20 0.30
MMP9 P14780 1/20 0.30
ALOX15 P16050 1/20 0.30
TP53 P04637 1/20 0.30
TDP1 Q9NUW8 1/20 0.30

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
Ether SCHEMBL1807497 0.90 CA1 (0.38) CA1CA2ALDH1A1TSHRTP53
Ether SCHEMBL8576481 0.86 KDM4E (0.46) CA1CA2ALDH1A1TSHRUSP2
Ether SCHEMBL5027697 0.84 ALDH1A1 (0.36) CA1CA2ALDH1A1TSHRLMNA
Ether SCHEMBL660656 0.80 ALDH1A1 (0.38) CA1CA2ALDH1A1TSHRUSP2
Ether SCHEMBL3195201 0.80 CA1 (0.53) CA1CA2ALDH1A1
Methanesulfonic Acid Methyl Ester SCHEMBL1185064 0.78 TSHR (0.62) CA1CA2ALDH1A1TSHRUSP2
Ether SCHEMBL10340529 0.76 CA1 (0.38) CA1CA2ALDH1A1TSHR
Ether SCHEMBL7490052 0.76 CA1 (0.38) CA1CA2ALDH1A1TSHR
Ether SCHEMBL1469697 0.76 CA1 (0.38) CA1CA2ALDH1A1TSHR
Ether SCHEMBL27570944 0.76 CA5A (0.43) CA1CA2ALDH1A1TSHRKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9248117-B2 Substituted N,N-dihaloamines as antimicrobials NOVABAY PHARMACEUTICALS, INC. (US) 2016-02-02 US disclosed
EP-2629607-A2 ANTIMICROBIAL POLYETHER AND POLYOL COMPOUNDS NovaBay Pharmaceuticals, Inc. (US) 2013-08-28 EP disclosed
CN-101268046-B Carboxamide derivatives as muscarinic receptor antagonists PFIZER 2012-07-25 CN disclosed
US-20120129793-A1 Antimicrobial Polyether and Polyol Compounds NOVABAY PHARMACEUTICALS, INC. 2012-05-24 US disclosed
WO-2012054521-A2 ANTIMICROBIAL POLYETHER AND POLYOL COMPOUNDS NOVABAY PHARMACEUTICLAS, INC. (US) 2012-04-26 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 (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-20120129793-A1 Antimicrobial Polyether and Polyol Compounds POLR1C, DPM1, PRF1 CA1 4722/4885CA2 4795/4885ALDH1A1 1198/4885

“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.