SCHEMBL1714459

SCHEMBL1714459

NS(=O)(=O)c1cc(C(=O)O)c(NCc2cccs2)cc1Cl

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CISD1 Q9NZ45 12/20 1.00
▸ CA12 O43570 5/20 0.66
▸ CA1 P00915 5/20 0.66
▸ CA2 P00918 5/20 0.66
▸ CA6 P23280 5/20 0.66
▸ CA7 P43166 5/20 0.66
▸ CA9 Q16790 5/20 0.66
▸ CA14 Q9ULX7 5/20 0.66
▸ CA5B Q9Y2D0 5/20 0.66
▸ CA5A P35218 4/20 0.66
▸ ALDH1A1 P00352 1/20 0.66
▸ HTR1A P08908 1/20 0.66
▸ CA4 P22748 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
▸ PDE4D Q08499 1/20 0.58
▸ PDE3A Q14432 1/20 0.58
▸ CA3 P07451 4/20 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
SCHEMBL18426052 0.86 CISD1 (0.76) CISD1CA12CA1CA2CA6
SCHEMBL11788810 0.85 CISD1 (0.74) CISD1CA12CA1CA2CA6
SCHEMBL11789259 0.84 CISD1 (0.73) CISD1CA12CA1CA2CA6
SCHEMBL11875494 0.84 CISD1 (0.73) CISD1CA12CA1CA2CA6
SCHEMBL1716052 0.82 CISD1 (1.00) CISD1CA12CA1CA2CA6
SCHEMBL11708093 0.82 CISD1 (0.69) CISD1CA12CA1CA2CA6
SCHEMBL2873972 0.82 CISD1 (0.69) CISD1CA12CA1CA2CA6
SCHEMBL11787100 0.81 CISD1 (0.68) CISD1CA12CA1CA2CA6
SCHEMBL10963109 0.81 CISD1 (0.68) CISD1CA12CA1CA2CA6
Furosemide SCHEMBL29406913 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1697312-B1 HYDROXAMIC ACID ESTERS AND PHARMACEUTICAL USE THEREOF LEO PHARMA AS (DK) 2011-07-20 — — EP claimed
US-20070244117-A1 Novel Hydroxamic Acid Esters and Pharmaceutical Use Thereof LEO PHARMA A/S (DK) 2007-10-18 — — US claimed
EP-1697312-B1 HYDROXAMIC ACID ESTERS AND PHARMACEUTICAL USE THEREOF LEO PHARMA AS (DK) 2011-07-20 — — EP 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-20070244117-A1 Novel Hydroxamic Acid Esters and Pharmaceutical Use Thereof F9, F12, HDAC9 CISD1 1891/4885CA12 449/4885CA1 492/4885

“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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