SCHEMBL30049902

SCHEMBL30049902

CCC(=O)Nc1ccc(S(=O)(=O)N2CCCC3(CCN(CCC(C)(C)C)CC3)C2)cn1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 3/20 0.42
▸ SMN1; SMN2 Q16637 2/20 0.42
▸ L3MBTL1 Q9Y468 1/20 0.42
▸ LMNA P02545 1/20 0.42
▸ MAPT P10636 1/20 0.42
▸ HTT P42858 1/20 0.42
▸ NPSR1 Q6W5P4 1/20 0.42
▸ F13A1 P00488 1/20 0.42
▸ TGM2 P21980 1/20 0.42
▸ TGM1 P22735 1/20 0.42
▸ TSHR P16473 4/20 0.42
▸ NAMPT P43490 3/20 0.41
▸ CYP3A4 P08684 5/20 0.41
▸ CYP1A2 P05177 4/20 0.41
▸ CYP2D6 P10635 4/20 0.41
▸ USP2 O75604 2/20 0.41
▸ KDM4E B2RXH2 2/20 0.40
▸ POLB P06746 1/20 0.40
▸ GAA P10253 1/20 0.40
▸ CYP2C9 P11712 1/20 0.39

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
SCHEMBL27162525 1.00 ALDH1A1 (0.42) ALDH1A1SMN1; SMN2L3MBTL1LMNAMAPT
SCHEMBL30049149 0.93 L3MBTL1 (0.42) ALDH1A1SMN1; SMN2L3MBTL1LMNAMAPT
SCHEMBL27162178 0.93 L3MBTL1 (0.42) ALDH1A1SMN1; SMN2L3MBTL1LMNAMAPT
SCHEMBL30049872 0.89 TSHR (0.45) ALDH1A1SMN1; SMN2L3MBTL1LMNAMAPT
SCHEMBL27162655 0.89 TSHR (0.45) ALDH1A1SMN1; SMN2L3MBTL1LMNAMAPT
SCHEMBL30049764 0.85 TSHR (0.45) ALDH1A1SMN1; SMN2LMNAMAPTHTT
SCHEMBL27162034 0.85 TSHR (0.45) ALDH1A1SMN1; SMN2LMNAMAPTHTT
SCHEMBL27162691 0.85 TSHR (0.46) ALDH1A1SMN1; SMN2LMNAMAPTHTT
SCHEMBL30049578 0.85 TSHR (0.46) ALDH1A1SMN1; SMN2LMNAMAPTHTT
SCHEMBL30050023 0.84 GAA (0.40) ALDH1A1SMN1; SMN2LMNAMAPTHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4330248-A1 PYRIDINE-SULFONAMIDE DERIVATIVES AS SIGMA LIGANDS Acondicionamiento Tarrasense (ES) 2024-03-06 — — EP claimed
WO-2022229405-A1 PYRIDINE-SULFONAMIDE DERIVATIVES AS SIGMA LIGANDS ACONDICIONAMIENTO TARRASENSE (ES) 2022-11-03 — — WO claimed
EP-4330248-A1 PYRIDINE-SULFONAMIDE DERIVATIVES AS SIGMA LIGANDS Acondicionamiento Tarrasense (ES) 2024-03-06 — — EP disclosed
WO-2022229405-A1 PYRIDINE-SULFONAMIDE DERIVATIVES AS SIGMA LIGANDS ACONDICIONAMIENTO TARRASENSE (ES) 2022-11-03 — — WO disclosed
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