SCHEMBL15833855

SCHEMBL15833855

CCCCCCC(CC(CCCCCCCCC(=O)OC)S(=O)(=O)CC)S(=O)(=O)CC

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CA12 O43570 2/20 0.48
▸ CA14 Q9ULX7 2/20 0.48
▸ CA2 P00918 1/20 0.48
▸ CA7 P43166 1/20 0.48
▸ CA9 Q16790 1/20 0.48
▸ PPARG P37231 2/20 0.45
▸ L3MBTL1 Q9Y468 1/20 0.44
▸ LMNA P02545 2/20 0.44
▸ POLB P06746 1/20 0.43
▸ POLA1 P09884 1/20 0.43
▸ PPARA Q07869 1/20 0.43
▸ DGKA P23743 1/20 0.42
▸ MAPT P10636 2/20 0.41
▸ ZDHHC7 Q9NXF8 1/20 0.41
▸ MAPK1 P28482 1/20 0.41
▸ TSHR P16473 1/20 0.41
▸ EPHX2 P34913 1/20 0.40
▸ MEN1 O00255 1/20 0.40
▸ HPGD P15428 1/20 0.40
▸ RECQL P46063 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
SCHEMBL15823932 0.96 CA12 (0.44) CA12CA14CA2CA7CA9
SCHEMBL15823849 0.94 CA12 (0.50) CA12CA14CA2CA7CA9
SCHEMBL15824674 0.94 CA12 (0.50) CA12CA14CA2CA7CA9
SCHEMBL15833854 0.92 CA12 (0.49) CA12CA14CA2CA7CA9
SCHEMBL15833856 0.92 CA12 (0.49) CA12CA14CA2CA7CA9
SCHEMBL15833853 0.92 CA12 (0.49) CA12CA14CA2CA7CA9
SCHEMBL17255846 0.88 FFAR4 (0.51) CA12CA14CA2CA7CA9
SCHEMBL15823706 0.85 CA12 (0.48) CA12CA14CA2CA7CA9
SCHEMBL15824123 0.85 CA12 (0.48) CA12CA14CA2CA7CA9
SCHEMBL15822897 0.85 CA12 (0.48) CA12CA14CA2CA7CA9

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-20150329484-A1 ESTER HAVING SULPHONE GROUP EVONIK DEGUSSA GMBH (DE) 2015-11-19 — — US disclosed
US-20150329484-A1 ESTER HAVING SULPHONE GROUP EVONIK DEGUSSA GMBH (DE) 2015-11-19 — — US disclosed
WO-2014095103-A1 ESTER HAVING A SULPHONIC GROUP EVONIK INDUSTRIES AG (DE) 2014-06-26 — — 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-20150329484-A1 ESTER HAVING SULPHONE GROUP STS, SULT1A1, TST CA12 3918/4885CA14 2379/4885CA2 4790/4885

“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.

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