SCHEMBL16852238

SCHEMBL16852238

CC(=O)ONS(=O)(=O)c1cccc(S(C)(=O)=O)c1

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.42
LMNA P02545 4/20 0.42
SMN1; SMN2 Q16637 2/20 0.41
GAA P10253 2/20 0.40
HSD17B10 Q99714 1/20 0.40
KMT2A Q03164 3/20 0.40
MEN1 O00255 2/20 0.39
MAPT P10636 2/20 0.39
HPGD P15428 2/20 0.39
NPC1 O15118 2/20 0.39
RAB9A P51151 2/20 0.39
KDM4E B2RXH2 1/20 0.39
TNNI3K Q59H18 1/20 0.39
NQO2 P16083 1/20 0.38
MTNR1A P48039 1/20 0.38
MTNR1B P49286 1/20 0.38
RXFP1 Q9HBX9 1/20 0.37
MEP1B Q16820 1/20 0.37

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
SCHEMBL12641698 0.85 ALDH1A1 (0.39) ALDH1A1LMNASMN1; SMN2GAAHSD17B10
SCHEMBL1925890 0.83 LMNA (0.43) ALDH1A1LMNASMN1; SMN2GAAHSD17B10
SCHEMBL1925985 0.83 ALDH1A1 (0.41) ALDH1A1LMNASMN1; SMN2GAAHSD17B10
SCHEMBL2026104 0.81 BCAT1 (0.55) LMNAGAAKMT2AKDM4E
SCHEMBL20377340 0.80 ATM (0.43) ALDH1A1SMN1; SMN2GAAHSD17B10MEP1B
SCHEMBL27903861 0.80 BCAT1 (0.53) LMNAGAAKMT2AKDM4E
SCHEMBL18770168 0.80 SMN1; SMN2 (0.43) ALDH1A1LMNASMN1; SMN2GAAHSD17B10
SCHEMBL27621985 0.79 CA1 (0.61) ALDH1A1GAAKMT2AMEN1
SCHEMBL15879184 0.75 CA1 (0.57) ALDH1A1LMNASMN1; SMN2GAAHSD17B10
SCHEMBL29528116 0.75 CA1 (0.57) ALDH1A1LMNASMN1; SMN2GAAHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240066002-A1 NITROXYL DONORS WITH IMPROVED THERAPEUTIC INDEX CARDIOXYL PHARMACEUTICALS, INC. 2024-02-29 US disclosed
US-11786501-B2 Nitroxyl donors with improved therapeutic index CARDIOXYL PHARMACEUTICALS, INC. (US) 2023-10-17 US disclosed
US-9968584-B2 Nitroxyl donors with improved therapeutic index CARDIOXYL PHARMACEUTICALS, INC. (US) 2018-05-15 US disclosed
US-20170151210-A1 NITROXYL DONORS WITH IMPROVED THERAPEUTIC INDEX CARDIOXYL PHARMACEUTICALS, INC. 2017-06-01 US disclosed
US-9156804-B2 Nitroxyl donors with improved therapeutic index CARDIOXYL PHARMACEUTICALS, INC. (US) 2015-10-13 US disclosed
US-20150175566-A1 NITROXYL DONORS WITH IMPROVED THERAPEUTIC INDEX CARDIOXYL PHARMACEUTICALS, INC. 2015-06-25 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 (4 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-11786501-B2 Nitroxyl donors with improved therapeutic index TNNI3, TNNT2, TNNC1 ALDH1A1 1005/4885LMNA 2293/4885SMN1; SMN2 339/4885
US-20150175566-A1 NITROXYL DONORS WITH IMPROVED THERAPEUTIC INDEX TNNI3, TNNT2, TNNC1 ALDH1A1 1005/4885LMNA 2293/4885SMN1; SMN2 339/4885
US-20240066002-A1 NITROXYL DONORS WITH IMPROVED THERAPEUTIC INDEX TNNI3, TNNT2, TNNC1 ALDH1A1 1005/4885LMNA 2293/4885SMN1; SMN2 339/4885
US-20170151210-A1 NITROXYL DONORS WITH IMPROVED THERAPEUTIC INDEX TNNI3, TNNT2, TNNC1 ALDH1A1 1005/4885LMNA 2293/4885SMN1; SMN2 339/4885

“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.