SCHEMBL20454818

SCHEMBL20454818

CCCc1cc(=O)[nH]c(SCC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)n1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ CA1 P00915 16/20 1.00
▸ CA2 P00918 16/20 1.00
▸ CA7 P43166 16/20 1.00
▸ CA13 Q8N1Q1 16/20 1.00
▸ CA12 O43570 13/20 1.00
▸ CA6 P23280 13/20 1.00
▸ ALDH1A1 P00352 3/20 0.61
▸ HSD17B10 Q99714 2/20 0.61
▸ MAPT P10636 2/20 0.61
▸ TP53 P04637 1/20 0.61
▸ ALOX15 P16050 1/20 0.61
▸ MAPK1 P28482 1/20 0.61
▸ NPSR1 Q6W5P4 1/20 0.56
▸ AKR1C4 P17516 1/20 0.56
▸ AKR1C3 P42330 1/20 0.56
▸ AKR1C2 P52895 1/20 0.56
▸ AKR1C1 Q04828 1/20 0.56

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
SCHEMBL18426446 0.86 CA1 (1.00) CA1CA2CA7CA13CA12
SCHEMBL18425013 0.84 CA1 (1.00) CA1CA2CA7CA13CA12
SCHEMBL18425075 0.76 CA1 (1.00) CA1CA2CA7CA13CA12
SCHEMBL18424098 0.75 CA1 (1.00) CA1CA2CA7CA13CA12
SCHEMBL18425601 0.74 CA1 (0.85) CA1CA2CA7CA13CA12
SCHEMBL30995677 0.74 AKR1C4 (0.81) CA1CA2CA7CA13CA12
SCHEMBL29003201 0.74 AKR1C4 (0.81) CA1CA2CA7CA13CA12
SCHEMBL18426071 0.73 CA1 (1.00) CA1CA2CA7CA13CA12
SCHEMBL29003272 0.73 AKR1C4 (0.89) CA1CA2CA7CA13CA12
SCHEMBL18425027 0.73 CA1 (1.00) CA1CA2CA7CA13CA12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180222856-A1 SELECTIVE INHIBITORS OF CARBONIC ANHYDRASE VILNIUS UNIVERSITY (LT) 2018-08-09 — — US claimed
EP-3328833-B1 SELECTIVE INHIBITORS OF CARBONIC ANHYDRASE UNIV VILNIUS (LT) 2025-08-06 — — EP disclosed
US-11312682-B2 Selective inhibitors of carbonic anhydrase VILNIUS UNIVERSITY (LT) 2022-04-26 — — US disclosed
US-20180222856-A1 SELECTIVE INHIBITORS OF CARBONIC ANHYDRASE VILNIUS UNIVERSITY (LT) 2018-08-09 — — 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 (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-11312682-B2 Selective inhibitors of carbonic anhydrase CA2, CA9, CA7 CA1 6/4885CA2 1/4885CA7 3/4885
US-20180222856-A1 SELECTIVE INHIBITORS OF CARBONIC ANHYDRASE CA9, CA2, CA7 CA1 6/4885CA2 2/4885CA7 3/4885

“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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