SCHEMBL30049494

SCHEMBL30049494

CC(=O)N(C)c1ccc(S(=O)(=O)N2CCCC3(CCN(CCC(C)(C)C)CC3)C2)cn1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 2/20 0.41
▸ MAPK1 P28482 1/20 0.41
▸ ALDH1A1 P00352 6/20 0.41
▸ KDM4E B2RXH2 5/20 0.41
▸ KMT2A Q03164 2/20 0.41
▸ TSHR P16473 5/20 0.40
▸ CYP1A2 P05177 5/20 0.39
▸ CYP3A4 P08684 5/20 0.39
▸ CYP2D6 P10635 5/20 0.39
▸ USP2 O75604 2/20 0.39
▸ NPSR1 Q6W5P4 3/20 0.39
▸ ATM Q13315 2/20 0.38
▸ SMN1; SMN2 Q16637 3/20 0.38
▸ CYP2C9 P11712 1/20 0.38
▸ CYP2C19 P33261 1/20 0.38
▸ NAMPT P43490 2/20 0.37
▸ LMNA P02545 3/20 0.37
▸ HPGD P15428 2/20 0.37
▸ MCOLN3 Q8TDD5 1/20 0.37
▸ NLRP3 Q96P20 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
SCHEMBL27162739 1.00 GAA (0.41) GAAMAPK1ALDH1A1KDM4EKMT2A
SCHEMBL27162268 0.91 GAA (0.40) GAAMAPK1ALDH1A1KDM4EKMT2A
SCHEMBL30050023 0.91 GAA (0.40) GAAMAPK1ALDH1A1KDM4EKMT2A
SCHEMBL30051180 0.90 TSHR (0.44) GAAMAPK1ALDH1A1KDM4EKMT2A
SCHEMBL27162323 0.90 TSHR (0.44) GAAMAPK1ALDH1A1KDM4EKMT2A
SCHEMBL30049481 0.90 KDM4E (0.44) GAAMAPK1ALDH1A1KDM4EKMT2A
SCHEMBL27162039 0.90 KDM4E (0.44) GAAMAPK1ALDH1A1KDM4EKMT2A
SCHEMBL30049149 0.84 L3MBTL1 (0.42) GAAALDH1A1KDM4ETSHRCYP1A2
SCHEMBL27162178 0.84 L3MBTL1 (0.42) GAAALDH1A1KDM4ETSHRCYP1A2
SCHEMBL30049764 0.83 TSHR (0.45) GAAALDH1A1KDM4EKMT2ATSHR

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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