SCHEMBL21361570

SCHEMBL21361570

COc1ccccc1[C@H]1CCCN(S(=O)(=O)N2CCCN(CC3CCCCC3)CCCN(S(=O)(=O)c3ccc(N(C)C)cc3)C[C@H](C)C2)C1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 2/20 0.48
NPSR1 Q6W5P4 1/20 0.42
ALDH1A1 P00352 1/20 0.39
LMNA P02545 1/20 0.39
POLB P06746 1/20 0.38
PROKR1 Q8TCW9 1/20 0.37
CYP19A1 P11511 3/20 0.37
ADORA2A P29274 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
DRD2 P14416 1/20 0.36
DRD1 P21728 1/20 0.36
DRD4 P21917 1/20 0.36
DRD5 P21918 1/20 0.36
DRD3 P35462 1/20 0.36
KDM2B Q8NHM5 1/20 0.35
TSHR P16473 1/20 0.35
HTT P42858 1/20 0.35
GAA P10253 1/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35

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
SCHEMBL21361421 1.00 SCN9A (0.48) SCN9ANPSR1ALDH1A1LMNAPOLB
SCHEMBL21361537 0.87 SMN1; SMN2 (0.42) SCN9ANPSR1ALDH1A1POLBCYP19A1
SCHEMBL23102067 0.86 ALDH1A1 (0.46) ALDH1A1LMNAPOLBDRD2DRD4
SCHEMBL21361413 0.86 SCN9A (0.47) SCN9ANPSR1ALDH1A1LMNATSHR
SCHEMBL21361410 0.85 DRD2 (0.44) SCN9ANPSR1PROKR1DRD2DRD1
SCHEMBL23102066 0.85 NPSR1 (0.46) SCN9ANPSR1ALDH1A1LMNAPOLB
SCHEMBL24755914 0.84 NPSR1 (0.45) NPSR1ALDH1A1LMNAPOLBSMN1; SMN2
SCHEMBL23102215 0.84 NPSR1 (0.46) SCN9ANPSR1ALDH1A1LMNASMN1; SMN2
SCHEMBL23102082 0.84 NPSR1 (0.46) SCN9ANPSR1ALDH1A1LMNASMN1; SMN2
SCHEMBL24755310 0.84 NPSR1 (0.46) SCN9ANPSR1ALDH1A1LMNASMN1; 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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3765447-B1 TRIAZACYCLODODECANSULFONAMIDE (\"TCD\")-BASED PROTEIN SECRETION INHIBITORS KEZAR LIFE SCIENCES (US) 2023-07-12 EP disclosed
US-11578055-B2 Triazacyclododecansulfonamide (“TCD”)-based protein secretion inhibitors KEZAR LIFE SCIENCES (US) 2023-02-14 US disclosed
US-20220402891-A1 TRIAZACYCLODODECANSULFONAMIDE (TCD)-BASED PROTEIN SECRETION INHIBITORS ENODIA THERAPEUTICS SAS (FR) 2022-12-22 US disclosed
US-20210078974-A1 TRIAZACYCLODODECANSULFONAMIDE (\"TCD\")-BASED PROTEIN SECRETION INHIBITORS ENODIA THERAPEUTICS SAS (FR) 2021-03-18 US disclosed
WO-2019178510-A1 TRIAZACYCLODODECANSULFONAMIDE (\"TCD\")-BASED PROTEIN SECRETION INHIBITORS KEZAR LIFE SCIENCES (US) 2019-09-19 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 (3 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-11578055-B2 Triazacyclododecansulfonamide (“TCD”)-based protein secretion inhibitors SEC61B, SEC61A1, SEC61G SCN9A 1902/4885NPSR1 2606/4885ALDH1A1 4848/4885
US-20220402891-A1 TRIAZACYCLODODECANSULFONAMIDE (TCD)-BASED PROTEIN SECRETION INHIBITORS SEC61B, SEC61A1, SEC61G SCN9A 1931/4885NPSR1 2535/4885ALDH1A1 4834/4885
US-20210078974-A1 TRIAZACYCLODODECANSULFONAMIDE (\"TCD\")-BASED PROTEIN SECRETION INHIBITORS SEC61B, SEC61A1, SEC61G SCN9A 2033/4885NPSR1 2424/4885ALDH1A1 4817/4885

“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.