SCHEMBL31680049

SCHEMBL31680049

O=c1[nH]c2cc(Cl)c(S(=O)(=O)Nc3ccc(C(F)(F)F)cc3)cc2[nH]c1=O

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ THRB P10828 2/20 0.56
▸ LMNA P02545 2/20 0.54
▸ CDK1 P06493 1/20 0.51
▸ CCNB1 P14635 1/20 0.51
▸ CCNA2 P20248 1/20 0.51
▸ CCND1 P24385 1/20 0.51
▸ CDK2 P24941 1/20 0.51
▸ CDK7 P50613 1/20 0.51
▸ CCNH P51946 1/20 0.51
▸ CCNA1 P78396 1/20 0.51
▸ CDK6 Q00534 1/20 0.51
▸ MEN1 O00255 1/20 0.48
▸ KMT2A Q03164 1/20 0.48
▸ CA1 P00915 1/20 0.47
▸ CA2 P00918 1/20 0.47
▸ IDH1 O75874 1/20 0.46
▸ MCL1 Q07820 1/20 0.45
▸ PGAM1 P18669 1/20 0.45
▸ PKM P14618 3/20 0.44
▸ SGK1 O00141 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
SCHEMBL24876158 1.00 THRB (0.56) THRBLMNACDK1CCNB1CCNA2
SCHEMBL31679837 0.88 LMNA (0.58) THRBLMNAMEN1KMT2ACA1
SCHEMBL31679859 0.86 THRB (0.57) THRBLMNAMEN1KMT2ACA1
SCHEMBL24876665 0.86 THRB (0.57) THRBLMNAMEN1KMT2ACA1
SCHEMBL24876391 0.85 LMNA (0.58) THRBLMNACDK1CCNB1CCNA2
SCHEMBL31679800 0.85 LMNA (0.58) THRBLMNACDK1CCNB1CCNA2
SCHEMBL24876645 0.85 THRB (0.76) THRBLMNAMEN1KMT2AIDH1
SCHEMBL31680055 0.85 THRB (0.76) THRBLMNAMEN1KMT2AIDH1
SCHEMBL24876314 0.84 MAPT (0.52) THRBLMNAMEN1KMT2AIDH1
SCHEMBL31679967 0.84 MAPT (0.52) THRBLMNAMEN1KMT2AIDH1

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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