SCHEMBL5540719

SCHEMBL5540719

NS(=O)(=O)c1cc(-c2nnnn2COC(=O)c2ccccc2)c(NCc2cccs2)cc1Cl

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDE4D Q08499 1/20 0.55
▸ PDE3A Q14432 1/20 0.55
▸ CISD1 Q9NZ45 3/20 0.54
▸ POLB P06746 2/20 0.40
▸ LMNA P02545 1/20 0.38
▸ HPGD P15428 1/20 0.38
▸ CA1 P00915 9/20 0.37
▸ CA2 P00918 9/20 0.37
▸ CA12 O43570 8/20 0.37
▸ CA9 Q16790 8/20 0.37
▸ CA7 P43166 7/20 0.37
▸ CA5B Q9Y2D0 7/20 0.37
▸ CA6 P23280 6/20 0.37
▸ CA14 Q9ULX7 6/20 0.37
▸ CA5A P35218 6/20 0.37
▸ CA3 P07451 5/20 0.37
▸ CA13 Q8N1Q1 5/20 0.37
▸ APEX1 P27695 1/20 0.37
▸ TDP1 Q9NUW8 1/20 0.37
▸ ALDH1A1 P00352 4/20 0.36

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
SCHEMBL230505 0.89 PDE4D (0.54) PDE4DPDE3ACISD1POLBLMNA
SCHEMBL29436060 0.88 PDE4D (0.53) PDE4DPDE3ACISD1POLBCA1
SCHEMBL231445 0.88 PDE4D (0.53) PDE4DPDE3ACISD1POLBCA1
SCHEMBL231731 0.88 PDE4D (0.54) PDE4DPDE3ACISD1POLBCA1
SCHEMBL230303 0.86 PDE4D (0.58) PDE4DPDE3ACISD1POLBCA1
SCHEMBL231240 0.85 PDE4D (0.61) PDE4DPDE3ACISD1POLBLMNA
SCHEMBL12522803 0.85 PDE4D (0.56) PDE4DPDE3ACISD1POLBCA1
SCHEMBL230673 0.83 PDE4D (0.58) PDE4DPDE3ACISD1POLBCA1
SCHEMBL18993718 0.81 PDE4D (0.59) PDE4DPDE3ACISD1POLBLMNA
SCHEMBL18993721 0.80 PDE4D (0.62) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070149526-A1 Diuretic and diuretic-like compound analogs NEUROTHERAPEUTICS PHARMA, L.L.C. 2007-06-28 — — 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 (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-20070149526-A1 Diuretic and diuretic-like compound analogs AQP4, AVPR2, AQP1 PDE4D 89/4885PDE3A 125/4885CISD1 2281/4885

“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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