SCHEMBL23560752

SCHEMBL23560752

Cc1ccc(S(=O)(=O)n2c(C)nc3cc(Br)ccc32)cc1

nearest known ligand 0.67

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 1/20 0.67
▸ ALDH3A1 P30838 7/20 0.66
▸ TP53 P04637 2/20 0.54
▸ NOD1 Q9Y239 2/20 0.49
▸ GAA P10253 2/20 0.49
▸ CXCL8 P10145 1/20 0.49
▸ NOD2 Q9HC29 1/20 0.49
▸ FABP4 P15090 2/20 0.47
▸ ALDH1A1 P00352 2/20 0.46
▸ HTT P42858 2/20 0.46
▸ HPGD P15428 1/20 0.46
▸ HSD17B10 Q99714 1/20 0.46
▸ TSHR P16473 3/20 0.45
▸ MAPK1 P28482 1/20 0.45
▸ SMN1; SMN2 Q16637 1/20 0.45
▸ PARP1 P09874 1/20 0.45
▸ KDM4E B2RXH2 1/20 0.43
▸ APOBEC3A P31941 1/20 0.43
▸ APOBEC3G Q9HC16 1/20 0.43

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
SCHEMBL11608199 0.82 LMNA (0.46) LMNAALDH3A1TP53NOD1GAA
SCHEMBL1272442 0.78 ACLY (0.48) LMNAALDH3A1TP53NOD1GAA
SCHEMBL15910233 0.78 HTR6 (0.47) LMNAALDH3A1TP53GAAALDH1A1
SCHEMBL30661141 0.78 HTR6 (0.47) LMNAALDH3A1TP53GAAALDH1A1
SCHEMBL23560964 0.76 ALDH3A1 (0.56) LMNAALDH3A1NOD1GAACXCL8
SCHEMBL22670414 0.75 LMNA (0.46) LMNAALDH3A1TP53NOD1GAA
SCHEMBL15074499 0.72 HTT (0.66) LMNAALDH3A1TP53NOD1GAA
SCHEMBL8545209 0.72 HTR6 (0.53) LMNAALDH3A1TP53NOD1GAA
SCHEMBL1272465 0.72 OPRD1 (0.45) LMNAALDH3A1TP53GAA
SCHEMBL6958148 0.72 MCL1 (0.55) LMNATP53NOD1NOD2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2021123291-A1 OGA INHIBITOR COMPOUNDS JANSSEN PHARMACEUTICA NV (BE) 2021-06-24 — — WO disclosed
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