SCHEMBL21436582

SCHEMBL21436582

CN(C)C=NS(=O)(=O)c1cc(N)c(Oc2ccccc2)s1

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 2/20 0.37
▸ GAA P10253 1/20 0.37
▸ HPGD P15428 1/20 0.35
▸ HTT P42858 1/20 0.35
▸ SMN1; SMN2 Q16637 2/20 0.34
▸ BCAT1 P54687 1/20 0.33
▸ NPC1 O15118 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ POLB P06746 1/20 0.31
▸ HSP90AA1 P07900 1/20 0.31
▸ RAB9A P51151 1/20 0.31
▸ SOS1 Q07889 1/20 0.31
▸ CA1 P00915 1/20 0.31
▸ CA2 P00918 1/20 0.31
▸ CA9 Q16790 1/20 0.31
▸ PGR P06401 2/20 0.30
▸ PPARG P37231 1/20 0.30

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
SCHEMBL22922703 1.00 LMNA (0.37) LMNAGAAHPGDHTTSMN1; SMN2
SCHEMBL21436580 1.00 LMNA (0.37) LMNAGAAHPGDHTTSMN1; SMN2
SCHEMBL21436474 0.83 LMNA (0.38) LMNAGAAHPGDHTTSMN1; SMN2
SCHEMBL21436471 0.83 LMNA (0.38) LMNAGAAHPGDHTTSMN1; SMN2
SCHEMBL21436494 0.77 HPGD (0.41) LMNAHPGDHTTALDH1A1CA2
SCHEMBL22922704 0.77 HPGD (0.41) LMNAHPGDHTTALDH1A1CA2
SCHEMBL21436493 0.77 HPGD (0.41) LMNAHPGDHTTALDH1A1CA2
SCHEMBL573731 0.68 HPGD (0.43) LMNAGAAHPGDHTTSMN1; SMN2
SCHEMBL8260574 0.67 LMNA (0.43) LMNAGAAHPGDSMN1; SMN2BCAT1
SCHEMBL21453464 0.66 ALDH1A1 (0.42) LMNAGAAHTTSMN1; SMN2NPC1

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-3774763-A1 BUMETANIDE DERIVATIVES FOR THE THERAPY OF HYPERHIDROSIS ZILENTIN AG (CH) 2021-02-17 — — EP disclosed
US-20210022978-A1 BUMETANIDE DERIVATIVES FOR THE THERAPY OF HYPERHIDROSIS Zilentin AG (CH) 2021-01-28 — — US disclosed
WO-2019193159-A1 BUMETANIDE DERIVATIVES FOR THE THERAPY OF HYPERHIDROSIS Universität Wien (AT) 2019-10-10 — — 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-20210022978-A1 BUMETANIDE DERIVATIVES FOR THE THERAPY OF HYPERHIDROSIS SLC9A1, SLC9A3, SLC5A1 LMNA 4608/4885GAA 649/4885HPGD 524/4885

“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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