SCHEMBL24876051

SCHEMBL24876051

Cc1ccc(-c2ccc(NS(=O)(=O)c3cc4[nH]c(=O)c(=O)[nH]c4cc3C)cc2)cc1

nearest known ligand 0.71

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ PKM P14618 5/20 0.71
▸ MEN1 O00255 3/20 0.70
▸ KMT2A Q03164 3/20 0.70
▸ LMNA P02545 5/20 0.67
▸ THRB P10828 2/20 0.60
▸ GAA P10253 2/20 0.58
▸ ALDH1A1 P00352 2/20 0.55
▸ MAPT P10636 2/20 0.55
▸ KDM4E B2RXH2 1/20 0.55
▸ HPGD P15428 1/20 0.55
▸ POLB P06746 3/20 0.54

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
SCHEMBL31679904 1.00 PKM (0.71) PKMMEN1KMT2ALMNATHRB
SCHEMBL24876742 0.96 PKM (0.76) PKMMEN1KMT2ALMNATHRB
SCHEMBL24876755 0.91 MEN1 (0.69) PKMMEN1KMT2ALMNATHRB
SCHEMBL24876679 0.89 PKM (0.66) PKMMEN1KMT2ALMNATHRB
SCHEMBL31679949 0.89 MEN1 (0.63) PKMMEN1KMT2ALMNATHRB
SCHEMBL24876027 0.89 MEN1 (0.63) PKMMEN1KMT2ALMNATHRB
SCHEMBL31679847 0.88 KMT2A (0.66) PKMMEN1KMT2ALMNATHRB
SCHEMBL24876631 0.88 KMT2A (0.66) PKMMEN1KMT2ALMNATHRB
SCHEMBL24876680 0.86 LMNA (0.66) PKMMEN1KMT2ALMNATHRB
SCHEMBL31679810 0.86 LMNA (0.73) PKMMEN1KMT2ALMNATHRB

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-2023280970-A1 INHIBITORS OF ALPHA-HEMOLYSIN OF STAPHYLOCOCCUS AUREUS Helmholtz-Zentrum für Infektionsforschung GmbH (DE) 2023-01-12 — — WO disclosed
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