SCHEMBL24876625

SCHEMBL24876625

Cc1cc2[nH]c(=O)c(=O)[nH]c2cc1S(=O)(=O)Nc1ccc(N2CCOCC2)c(Br)c1

nearest known ligand 0.57

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 2/20 0.57
▸ MEN1 O00255 1/20 0.52
▸ KMT2A Q03164 1/20 0.52
▸ PKM P14618 4/20 0.51
▸ THRB P10828 2/20 0.50
▸ MAPT P10636 2/20 0.47
▸ ACP1 P24666 2/20 0.46
▸ GAA P10253 1/20 0.46
▸ POLB P06746 3/20 0.45
▸ GBA1 P04062 1/20 0.44

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
SCHEMBL31679924 1.00 LMNA (0.57) LMNAMEN1KMT2APKMTHRB
SCHEMBL31679829 0.89 LMNA (0.71) LMNAMEN1KMT2APKMTHRB
SCHEMBL24876106 0.85 LMNA (0.66) LMNAMEN1KMT2APKMTHRB
SCHEMBL31679807 0.85 LMNA (0.61) LMNAMEN1KMT2APKMTHRB
SCHEMBL24876749 0.85 LMNA (0.61) LMNAMEN1KMT2APKMTHRB
SCHEMBL31680019 0.81 LMNA (0.52) LMNAMEN1KMT2APKMTHRB
SCHEMBL31679867 0.79 LMNA (0.75) LMNAMEN1KMT2APKMTHRB
SCHEMBL24876095 0.78 LMNA (0.69) LMNAMEN1KMT2APKMTHRB
SCHEMBL24876094 0.77 LMNA (0.64) LMNAMEN1KMT2APKMTHRB
SCHEMBL24876736 0.76 KMT2A (0.63) 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
Send feedback