SCHEMBL18993718

SCHEMBL18993718

CC(=O)n1nnnc1-c1cc(S(N)(=O)=O)c(Cl)cc1NCc1cccs1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDE4D Q08499 1/20 0.59
▸ PDE3A Q14432 1/20 0.59
▸ CISD1 Q9NZ45 4/20 0.58
▸ POLB P06746 4/20 0.40
▸ LMNA P02545 1/20 0.40
▸ F2 P00734 1/20 0.39
▸ RAB9A P51151 1/20 0.39
▸ CA1 P00915 6/20 0.38
▸ CA2 P00918 6/20 0.38
▸ CA7 P43166 6/20 0.38
▸ CA5B Q9Y2D0 6/20 0.38
▸ CA5A P35218 5/20 0.38
▸ CA12 O43570 5/20 0.38
▸ CA6 P23280 5/20 0.38
▸ CA9 Q16790 5/20 0.38
▸ CA14 Q9ULX7 5/20 0.38
▸ ALDH1A1 P00352 2/20 0.38
▸ HTR1A P08908 1/20 0.38
▸ CA4 P22748 1/20 0.38
▸ HSD11B1 P28845 1/20 0.38

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
SCHEMBL18993721 0.87 PDE4D (0.62) PDE4DPDE3ACISD1POLBRAB9A
SCHEMBL231240 0.86 PDE4D (0.61) PDE4DPDE3ACISD1POLBLMNA
SCHEMBL230673 0.85 PDE4D (0.58) PDE4DPDE3ACISD1POLBCA1
SCHEMBL16581034 0.85 PDE4D (0.58) PDE4DPDE3ACISD1POLBCA1
SCHEMBL230303 0.83 PDE4D (0.58) PDE4DPDE3ACISD1POLBCA1
SCHEMBL230505 0.83 PDE4D (0.54) PDE4DPDE3ACISD1POLBLMNA
SCHEMBL231445 0.83 PDE4D (0.53) PDE4DPDE3ACISD1POLBF2
SCHEMBL29436060 0.83 PDE4D (0.53) PDE4DPDE3ACISD1POLBF2
SCHEMBL5540719 0.81 PDE4D (0.55) PDE4DPDE3ACISD1POLBLMNA
SCHEMBL12522803 0.80 PDE4D (0.56) PDE4DPDE3ACISD1POLBCA1

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
US-20190151263-A1 BUMETANIDE ANALGOS, COMPOSITIONS, AND METHODS OF USE NEUROPRO THERAPEUTICS INC (US) 2019-05-23 — — US disclosed
US-20170246131-A1 BUMETANIDE ANALOGS, COMPOSITIONS, AND METHODS OF USE NEUROPRO THERAPEUTICS INC (US) 2017-08-31 — — US disclosed
US-9682928-B2 Bumetanide analogs, compositions and methods of use NEUROPRO THERAPEUTICS, INC. (US) 2017-06-20 — — 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-20170246131-A1 BUMETANIDE ANALOGS, COMPOSITIONS, AND METHODS OF USE SLC6A1, SLC6A13, SLC6A11 PDE4D 597/4885PDE3A 441/4885CISD1 3887/4885
US-20190151263-A1 BUMETANIDE ANALGOS, COMPOSITIONS, AND METHODS OF USE SLC6A1, SLC6A11, SLC6A13 PDE4D 855/4885PDE3A 416/4885CISD1 3822/4885

“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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