SCHEMBL20187448

SCHEMBL20187448

CS(=O)(=O)OCCc1ccc(C2CC2)cc1

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SPHK1 Q9NYA1 12/20 0.42
KCNA5 P22460 1/20 0.41
KCNH2 Q12809 1/20 0.41
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
CA9 Q16790 1/20 0.39
FFAR4 Q5NUL3 3/20 0.38
SPHK2 Q9NRA0 7/20 0.37
KDM4E B2RXH2 1/20 0.36
USP2 O75604 1/20 0.36
ALDH1A1 P00352 1/20 0.36
LMNA P02545 1/20 0.36
MMP9 P14780 1/20 0.36
ALOX15 P16050 1/20 0.36
TSHR P16473 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
SCHEMBL16395397 0.84 FFAR4 (0.42) SPHK1FFAR4KDM4EUSP2ALDH1A1
SCHEMBL3258334 0.84 CA2 (0.50) KCNH2CA1CA2CA9KDM4E
SCHEMBL16395088 0.83 FFAR4 (0.41) SPHK1KCNH2FFAR4KDM4EUSP2
SCHEMBL4665092 0.83 CA2 (0.42) SPHK1KCNA5KCNH2CA1CA2
SCHEMBL21901766 0.80 CA2 (0.36) KCNA5KCNH2CA1CA2CA9
SCHEMBL6223412 0.77 ALDH1A1 (0.39) CA1CA2CA9KDM4EUSP2
SCHEMBL17891745 0.77 CA2 (0.44) CA1CA2CA9KDM4EUSP2
SCHEMBL1981592 0.77 SPHK1 (0.47) SPHK1FFAR4SPHK2
SCHEMBL6991225 0.77 CA1 (0.48) KCNH2CA1CA2CA9KDM4E
SCHEMBL13527822 0.77 CA2 (0.50) CA1CA2CA9FFAR4KDM4E

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-3544979-B1 OXADIAZOLONES AS TRANSIENT RECEPTOR POTENTIAL CHANNEL INHIBITORS HOFFMANN LA ROCHE (CH) 2021-08-04 EP disclosed
US-10913742-B2 Oxadiazolones as transient receptor potential channel inhibitors GENENTECH, INC. (US) 2021-02-09 US disclosed
EP-3544979-A1 OXADIAZOLONES AS TRANSIENT RECEPTOR POTENTIAL CHANNEL INHIBITORS H. Hoffnabb-La Roche Ag (CH) 2019-10-02 EP disclosed
US-20190284189-A1 OXADIAZOLONES AS TRANSIENT RECEPTOR POTENTIAL CHANNEL INHIBITORS GENENTECH, INC. (US) 2019-09-19 US disclosed
CN-110225911-A Oxadiazolone transient receptor potential channel inhibitors 豪夫迈·罗氏有限公司 2019-09-10 CN disclosed
WO-2018096159-A1 OXADIAZOLONES AS TRANSIENT RECEPTOR POTENTIAL CHANNEL INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2018-05-31 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-10913742-B2 Oxadiazolones as transient receptor potential channel inhibitors TRPA1, TRPV1, TRPV3 SPHK1 1377/4885KCNA5 110/4885KCNH2 65/4885
US-20190284189-A1 OXADIAZOLONES AS TRANSIENT RECEPTOR POTENTIAL CHANNEL INHIBITORS TRPA1, TRPV1, TRPV3 SPHK1 1377/4885KCNA5 110/4885KCNH2 65/4885

“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.