SCHEMBL22515417

SCHEMBL22515417

NS(=O)(=O)c1cc(C(=O)O)c(NCc2ccoc2)cc1Cl

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CISD1 Q9NZ45 14/20 0.73
▸ CA12 O43570 7/20 0.66
▸ CA1 P00915 7/20 0.66
▸ CA2 P00918 7/20 0.66
▸ CA6 P23280 7/20 0.66
▸ CA7 P43166 7/20 0.66
▸ CA9 Q16790 7/20 0.66
▸ CA14 Q9ULX7 7/20 0.66
▸ CA5B Q9Y2D0 7/20 0.66
▸ CA5A P35218 6/20 0.66
▸ CA4 P22748 2/20 0.66
▸ ALDH1A1 P00352 1/20 0.66
▸ HTR1A P08908 1/20 0.66
▸ HSD11B1 P28845 1/20 0.66
▸ SLC10A1 Q14973 1/20 0.66
▸ GPR35 Q9HC97 1/20 0.66
▸ ABCG2 Q9UNQ0 1/20 0.66
▸ CA3 P07451 6/20 0.59
▸ CA13 Q8N1Q1 6/20 0.59
▸ APP P05067 1/20 0.50

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
SCHEMBL11823275 0.89 CISD1 (0.57) CISD1CA12CA1CA2CA6
SCHEMBL11818526 0.86 CISD1 (0.62) CISD1CA12CA1CA2CA6
SCHEMBL1716052 0.84 CISD1 (1.00) CISD1CA12CA1CA2CA6
SCHEMBL11790756 0.83 CISD1 (0.58) CISD1CA12CA1CA2CA6
SCHEMBL11778816 0.81 CISD1 (0.48) CISD1CA12CA1CA2CA6
SCHEMBL11788087 0.81 CISD1 (0.53) CISD1CA12CA1CA2CA6
Aniline SCHEMBL11799081 0.81 CISD1 (0.53) CISD1CA12CA1CA2CA6
SCHEMBL11788824 0.81 CISD1 (0.53) CISD1CA12CA1CA2CA6
Furosemide SCHEMBL29406913 0.80 CISD1 (1.00) CISD1CA12CA1CA2CA6
Furosemide SCHEMBL428921 0.80 CISD1 (1.00) CISD1CA12CA1CA2CA6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220184008-A1 MODULATORS OF INTRACELLULAR CHLORIDE CONCENTRATION ALMA MATER STUDIORUM - UNIVERSITA' DI BOLOGNA (IT) 2022-06-16 — — US disclosed
WO-2020202072-A1 MODULATORS OF INTRACELLULAR CHLORIDE CONCENTRATION FONDAZIONE ISTITUTO ITALIANO DI TECNOLOGIA (IT) 2020-10-08 — — 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-20220184008-A1 MODULATORS OF INTRACELLULAR CHLORIDE CONCENTRATION SLC6A1, SLC6A13, SLC6A11 CISD1 1949/4885CA12 2754/4885CA1 667/4885

“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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