SCHEMBL31679954

SCHEMBL31679954

CCCc1ccc(NS(=O)(=O)c2cc3[nH]c(=O)c(=O)[nH]c3cc2C(C)C)cc1

nearest known ligand 0.59

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 2/20 0.59
▸ MEN1 O00255 1/20 0.59
▸ CYP26A1 O43174 2/20 0.47
▸ POLB P06746 2/20 0.46
▸ LMNA P02545 4/20 0.45
▸ PKM P14618 2/20 0.43
▸ ALDH1A1 P00352 1/20 0.43
▸ KIT P10721 1/20 0.41
▸ THRB P10828 2/20 0.41
▸ MAPT P10636 1/20 0.41
▸ SMN1; SMN2 Q16637 1/20 0.41
▸ HDAC1 Q13547 1/20 0.40
▸ GAA P10253 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
SCHEMBL24876297 1.00 KMT2A (0.59) KMT2AMEN1CYP26A1POLBLMNA
SCHEMBL24876302 0.84 MEN1 (0.81) KMT2AMEN1POLBLMNAPKM
SCHEMBL24876025 0.83 MEN1 (0.61) KMT2AMEN1POLBLMNAPKM
SCHEMBL24876113 0.83 MEN1 (0.61) KMT2AMEN1POLBLMNAPKM
SCHEMBL24876015 0.83 MEN1 (0.61) KMT2AMEN1POLBLMNAPKM
SCHEMBL31679956 0.80 THRB (0.56) KMT2AMEN1CYP26A1POLBLMNA
SCHEMBL24876310 0.80 THRB (0.56) KMT2AMEN1CYP26A1POLBLMNA
SCHEMBL24876301 0.79 MEN1 (0.47) KMT2AMEN1CYP26A1POLBLMNA
SCHEMBL24876294 0.77 MAPT (0.49) KMT2AMEN1POLBLMNAPKM
SCHEMBL31679831 0.77 MAPT (0.49) KMT2AMEN1POLBLMNAPKM

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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