SCHEMBL24953045

SCHEMBL24953045

COc1ccc([S+]([O-])c2ccc(OC)c(OC)c2)cc1OC

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 4/20 0.48
CA12 O43570 3/20 0.48
CA1 P00915 3/20 0.48
CA7 P43166 3/20 0.48
CA9 Q16790 3/20 0.48
CA14 Q9ULX7 3/20 0.48
ACHE P22303 1/20 0.48
TSHR P16473 3/20 0.47
POLB P06746 1/20 0.47
MAPK1 P28482 1/20 0.47
ALDH1A1 P00352 5/20 0.43
CYP1A2 P05177 2/20 0.42
CYP3A4 P08684 1/20 0.42
CYP2C9 P11712 1/20 0.42
CYP2C19 P33261 1/20 0.42
CA4 P22748 2/20 0.41
PDE4A P27815 1/20 0.41
NR3C1 P04150 1/20 0.41
CA6 P23280 1/20 0.41
TPMT P51580 1/20 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
SCHEMBL7322411 0.84 CA2 (0.46) CA2CA12CA1CA7CA9
SCHEMBL7322406 0.84 CA2 (0.46) CA2CA12CA1CA7CA9
SCHEMBL14618103 0.83 CA2 (0.45) CA2CA12CA1CA7CA9
SCHEMBL30884175 0.81 CA2 (0.52) CA2CA12CA1CA7CA9
Hydrochloric Acid SCHEMBL30884170 0.79 CA2 (0.50) CA2CA12CA1CA7CA9
SCHEMBL30889042 0.78 CA2 (0.42) CA2CA12CA1CA7CA9
Perchlorate SCHEMBL11656933 0.77 CA2 (0.43) CA2CA12CA1CA7CA9
SCHEMBL11986338 0.74 CA2 (0.39) CA2CA12CA1CA7CA9
SCHEMBL11986333 0.74 CA2 (0.39) CA2CA12CA1CA7CA9
SCHEMBL22693927 0.74 PDE4A (0.43) MAPK1ALDH1A1PDE4AMAPTHPGD

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-20230013430-A1 SULFONIUM SALT, ACID GENERATOR, RESIST COMPOSITION, AND METHOD FOR PRODUCING DEVICE TOYO GOSEI CO., LTD. (JP) 2023-01-19 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-20230013430-A1 SULFONIUM SALT, ACID GENERATOR, RESIST COMPOSITION, AND METHOD FOR PRODUCING DEVICE ARSA, SULT1A1, RER1 CA2 159/4885CA12 2195/4885CA1 326/4885

“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.