SCHEMBL24876258

SCHEMBL24876258

Cc1cc2[nH]c(=O)c(=O)[nH]c2cc1S(=O)(=O)Nc1ccc(C2=CCCCC2)c(Br)c1

nearest known ligand 0.53

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 5/20 0.53
▸ MEN1 O00255 2/20 0.53
▸ KMT2A Q03164 2/20 0.53
▸ PKM P14618 6/20 0.50
▸ THRB P10828 2/20 0.49
▸ GAA P10253 2/20 0.45
▸ POLB P06746 2/20 0.44
▸ MAPT P10636 1/20 0.40
▸ ALDH1A1 P00352 1/20 0.40

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
SCHEMBL31679874 1.00 LMNA (0.53) LMNAMEN1KMT2APKMTHRB
SCHEMBL31679979 0.88 LMNA (0.65) LMNAMEN1KMT2APKMTHRB
SCHEMBL31679997 0.78 LMNA (0.57) LMNAMEN1KMT2APKMTHRB
SCHEMBL24876095 0.77 LMNA (0.69) LMNAMEN1KMT2APKMTHRB
SCHEMBL24876646 0.77 LMNA (0.65) LMNAMEN1KMT2APKMTHRB
SCHEMBL24876221 0.77 LMNA (0.53) LMNAMEN1KMT2APKMTHRB
SCHEMBL31679808 0.77 LMNA (0.53) LMNAMEN1KMT2APKMTHRB
SCHEMBL24876257 0.75 LMNA (0.54) LMNAMEN1KMT2APKMTHRB
SCHEMBL31680057 0.75 LMNA (0.54) LMNAMEN1KMT2APKMTHRB
SCHEMBL24876204 0.75 LMNA (0.56) LMNAMEN1KMT2APKMTHRB

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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