SCHEMBL23728205

SCHEMBL23728205

O=[N+]([O-])c1ccc(CS(=O)(=O)N2CCC2)cc1

nearest known ligand 0.68

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.54
TSHR P16473 1/20 0.54
ALDH1A1 P00352 3/20 0.52
HRH3 Q9Y5N1 1/20 0.50
FKBP1A P62942 1/20 0.50
KCNJ1 P48048 2/20 0.49
KCNH2 Q12809 2/20 0.49
LMNA P02545 2/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
TDP1 Q9NUW8 1/20 0.47
KDM4E B2RXH2 1/20 0.45

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
SCHEMBL1425482 0.97 HPGD (0.58) HPGDTSHRALDH1A1HRH3FKBP1A
SCHEMBL8896530 0.86 ALDH1A1 (0.58) ALDH1A1KCNJ1LMNASMN1; SMN2
SCHEMBL8898022 0.86 L3MBTL1 (0.64) HPGDALDH1A1HRH3KCNJ1KCNH2
SCHEMBL8897735 0.84 SMN1; SMN2 (0.57) HPGDTSHRALDH1A1HRH3LMNA
SCHEMBL4428749 0.78 ALDH1A1 (0.60) HPGDTSHRALDH1A1LMNASMN1; SMN2
SCHEMBL4185130 0.77 HTT (0.46) ALDH1A1HRH3KCNJ1KCNH2LMNA
SCHEMBL5650248 0.77 HTT (0.46) ALDH1A1HRH3KCNJ1KCNH2LMNA
SCHEMBL14405008 0.77 HTT (0.46) ALDH1A1HRH3KCNJ1KCNH2LMNA
SCHEMBL17676780 0.77 ALDH1A1 (0.46) ALDH1A1HRH3KCNJ1KCNH2LMNA
SCHEMBL21681941 0.76 ALDH1A1 (0.74) ALDH1A1LMNASMN1; SMN2

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-20230133132-A1 NAMPT MODULATORS CYTOKINETICS, INC. 2023-05-04 US disclosed
US-20230133132-A1 NAMPT MODULATORS CYTOKINETICS, INC. 2023-05-04 US disclosed
US-20230133132-A1 NAMPT MODULATORS CYTOKINETICS, INC. 2023-05-04 US disclosed
CN-115515934-A NAMPT modulators 赛特凯恩蒂克公司 2022-12-23 CN disclosed
EP-4100393-A1 NAMPT MODULATORS Cytokinetics, Inc. (US) 2022-12-14 EP disclosed
WO-2021159015-A1 NAMPT MODULATORS CYTOKINETICS, INC. (US) 2021-08-12 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-20230133132-A1 NAMPT MODULATORS NAMPT, MC4R, SIRT1 HPGD 355/4885TSHR 562/4885ALDH1A1 2019/4885

“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.