SCHEMBL22694183

SCHEMBL22694183

O=C(/C=C/c1ccc(O)cc1)OC(CS(=O)(=O)O)(C(F)(F)F)C(F)(F)F

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CA12 O43570 7/20 0.47
▸ CA7 P43166 7/20 0.47
▸ CA9 Q16790 7/20 0.47
▸ CA14 Q9ULX7 7/20 0.47
▸ AKR1B10 O60218 6/20 0.47
▸ AKR1B1 P15121 6/20 0.47
▸ CA4 P22748 4/20 0.47
▸ CA6 P23280 4/20 0.47
▸ CA5A P35218 4/20 0.47
▸ CA5B Q9Y2D0 4/20 0.47
▸ CA1 P00915 6/20 0.47
▸ CA2 P00918 4/20 0.47
▸ TYR P14679 3/20 0.47
▸ MAOB P27338 2/20 0.44
▸ MET P08581 1/20 0.44
▸ PTGS2 P35354 1/20 0.43
▸ GLO1 Q04760 1/20 0.43
▸ CAMK2A Q9UQM7 1/20 0.43
▸ BACE1 P56817 2/20 0.42
▸ F3 P13726 2/20 0.41

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
SCHEMBL22694187 0.86 AKR1B10 (0.48) CA12CA7CA9CA14AKR1B10
SCHEMBL22694189 0.84 CYP3A4 (0.45) AKR1B10AKR1B1METPTGS2CYP2D6
SCHEMBL22694185 0.84 SNCA (0.41) AKR1B10AKR1B1MAOBPTGS2BACE1
SCHEMBL22694182 0.82 CYP3A4 (0.47) PTGS2CYP2D6CYP2C9
SCHEMBL22694184 0.82 AKR1B10 (0.30) AKR1B10AKR1B1
SCHEMBL22694186 0.81 EPHX2 (0.57) CA12CA7CA9CA14AKR1B1
SCHEMBL22694220 0.80 ALOX5 (0.52) METPTGS2CYP2D6CYP2C9PKM
SCHEMBL22694219 0.80 GABBR2 (0.48) MAOBPTGS2CYP2C9
SCHEMBL22694188 0.80 NFKB1 (0.44) CA4CA1CA2MAOB
SCHEMBL22694292 0.76 LMNA (0.41) CA12CA7CA9CA14CA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200369605-A1 ONIUM SALT, CHEMICALLY AMPLIFIED RESIST COMPOSITION AND PATTERNING PROCESS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2020-11-26 — — US 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-20200369605-A1 ONIUM SALT, CHEMICALLY AMPLIFIED RESIST COMPOSITION AND PATTERNING PROCESS PAG1, SLC6A5, LBR CA12 2743/4885CA7 345/4885CA9 856/4885

“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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