SCHEMBL31679934

SCHEMBL31679934

O=c1[nH]c2cc(Br)c(S(=O)(=O)Nc3ccc(C4CC4)cc3)cc2[nH]c1=O

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 2/20 0.47
▸ KMT2A Q03164 2/20 0.47
▸ LMNA P02545 3/20 0.44
▸ PKM P14618 5/20 0.43
▸ THRB P10828 2/20 0.41
▸ POLB P06746 2/20 0.40
▸ ALDH1A1 P00352 1/20 0.40
▸ TP53 P04637 1/20 0.40
▸ MAPT P10636 1/20 0.40
▸ ATM Q13315 1/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.40
▸ WDR5 P61964 1/20 0.39
▸ GAA P10253 1/20 0.39
▸ HTT P42858 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
SCHEMBL24876644 0.85 MEN1 (0.66) MEN1KMT2ALMNAPKMTHRB
SCHEMBL31679999 0.85 MEN1 (0.47) MEN1KMT2ALMNAPKMTHRB
SCHEMBL24876013 0.85 LMNA (0.53) MEN1KMT2ALMNAPKMTHRB
SCHEMBL31679866 0.83 MEN1 (0.57) MEN1KMT2ALMNAPKMTHRB
SCHEMBL24876301 0.82 MEN1 (0.47) MEN1KMT2ALMNAPKMTHRB
SCHEMBL24876355 0.81 MEN1 (0.63) MEN1KMT2ALMNAPKMTHRB
SCHEMBL24876751 0.80 LMNA (0.48) MEN1KMT2ALMNAPKMTHRB
SCHEMBL24876014 0.80 MEN1 (0.62) MEN1KMT2ALMNAPKMTHRB
SCHEMBL24876073 0.80 LMNA (0.50) MEN1KMT2ALMNAPKMTHRB
SCHEMBL31680045 0.80 MEN1 (0.52) MEN1KMT2ALMNAPKMTHRB

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
EP-4367103-B1 INHIBITORS OF ALPHA-HEMOLYSIN OF STAPHYLOCOCCUS AUREUS HELMHOLTZ ZENTRUM INFEKTIONSFORSCHUNG GMBH (DE) 2025-09-03 — — EP disclosed
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