SCHEMBL31404880

SCHEMBL31404880

O=C(O)c1ccccc1NS(=O)(=O)c1ccc(Sc2ccc(Cl)c(Cl)c2)c([N+](=O)[O-])c1

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SLC25A1 P53007 1/20 0.72
▸ MEN1 O00255 5/20 0.55
▸ KMT2A Q03164 5/20 0.55
▸ LMNA P02545 1/20 0.55
▸ CASP6 P55212 4/20 0.54
▸ L3MBTL1 Q9Y468 4/20 0.54
▸ DNMT1 P26358 3/20 0.54
▸ APAF1 O14727 1/20 0.54
▸ KDM4A O75164 1/20 0.54
▸ DUSP3 P51452 1/20 0.54
▸ PTPN5 P54829 1/20 0.54
▸ PTPN11 Q06124 1/20 0.54
▸ KDM4C Q9H3R0 1/20 0.54
▸ ACLY P53396 1/20 0.51
▸ POLB P06746 3/20 0.50
▸ BCL2L1 Q07817 1/20 0.50
▸ TDP1 Q9NUW8 1/20 0.49
▸ SLC10A2 Q12908 1/20 0.48
▸ SLC10A1 Q14973 1/20 0.48
▸ SLC10A6 Q3KNW5 1/20 0.48

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
SCHEMBL31404895 0.90 SLC25A1 (0.57) SLC25A1CASP6L3MBTL1DNMT1APAF1
SCHEMBL31404877 0.88 SLC25A1 (0.55) SLC25A1MEN1KMT2ALMNACASP6
SCHEMBL31404897 0.88 SLC25A1 (0.55) SLC25A1MEN1KMT2ALMNACASP6
SCHEMBL31404876 0.88 SLC25A1 (0.55) SLC25A1MEN1KMT2ALMNACASP6
SCHEMBL31404886 0.88 SLC25A1 (0.55) SLC25A1MEN1KMT2ALMNACASP6
SCHEMBL31404893 0.86 SLC25A1 (0.52) SLC25A1MEN1KMT2ALMNACASP6
SCHEMBL31404889 0.86 ACLY (0.54) SLC25A1MEN1KMT2ACASP6L3MBTL1
SCHEMBL31404873 0.85 DNMT1 (0.50) SLC25A1MEN1KMT2ALMNADNMT1
SCHEMBL31404879 0.84 ALDH1A1 (0.56) SLC25A1L3MBTL1DNMT1ACLYTDP1
SCHEMBL29918322 0.84 SLC25A1 (1.00) SLC25A1MEN1KMT2ALMNACASP6

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-2025045173-A1 ANTIMICROBIAL COMPOUNDS AND METHODS OF USE THEREOF THE CHINESE UNIVERSITY OF HONG KONG (CN) 2025-03-06 — — WO disclosed
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