SCHEMBL30291940

SCHEMBL30291940

CC1(C)OB(c2ccc(S(=O)(=O)C3CC3)c(Cl)c2)OC1(C)C

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CA1 P00915 6/20 0.43
CA2 P00918 6/20 0.43
CA9 Q16790 6/20 0.43
CA12 O43570 1/20 0.43
CA3 P07451 1/20 0.43
CA4 P22748 1/20 0.43
CA6 P23280 1/20 0.43
CA5A P35218 1/20 0.43
CA7 P43166 1/20 0.43
CA14 Q9ULX7 1/20 0.43
CA5B Q9Y2D0 1/20 0.43
AAK1 Q2M2I8 1/20 0.37
LPL P06858 9/20 0.36
LIPG Q9Y5X9 9/20 0.36
EGFR P00533 1/20 0.33
IDO1 P14902 1/20 0.33
TDO2 P48775 1/20 0.33
ROCK1 Q13464 1/20 0.33
HIF1A Q16665 1/20 0.32

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
SCHEMBL24168894 1.00 CA1 (0.43) CA1CA2CA9CA12CA3
SCHEMBL30291959 0.87 CA1 (0.41) CA1CA2CA9CA12CA3
SCHEMBL24168540 0.87 CA1 (0.41) CA1CA2CA9CA12CA3
SCHEMBL2414637 0.80 CA1 (0.55) CA1CA2CA9CA12CA3
SCHEMBL23369966 0.79 AOC2 (0.48) CA1CA2CA9CA12CA3
SCHEMBL3110517 0.78 CA1 (0.49) CA1CA2CA9CA12CA3
SCHEMBL24168794 0.77 CA1 (0.46) CA1CA2CA9CA12CA3
SCHEMBL30291974 0.77 CA1 (0.46) CA1CA2CA9CA12CA3
SCHEMBL24169061 0.77 CA1 (0.40) CA1CA2CA9CA12CA3
SCHEMBL30228974 0.77 CA1 (0.40) CA1CA2CA9CA12CA3

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-12565497-B2 Sulfone derivatives HOFFMANN-LA ROCHE INC. (US) 2026-03-03 US disclosed
US-20230219953-A1 SULFONE DERIVATIVES HOFFMANN-LA ROCHE INC. (US) 2023-07-13 US disclosed
EP-4168392-A1 SULFONE DERIVATIVES F. Hoffmann-La Roche AG (CH) 2023-04-26 EP 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-20230219953-A1 SULFONE DERIVATIVES SULT1E1, SULT1A1, SULT2A1 CA1 1905/4885CA2 828/4885CA9 1730/4885
US-12565497-B2 Sulfone derivatives CXCR1, CCR1, SULT1E1 CA1 406/4885CA2 236/4885CA9 773/4885

“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.