SCHEMBL26064882

SCHEMBL26064882

Cn1nc(C(F)(F)F)cc1S(=O)(=O)N1CCN(C2CCOCC2)CC1

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 3/20 0.39
▸ KMT2A Q03164 3/20 0.39
▸ HPGD P15428 1/20 0.39
▸ NAMPT P43490 5/20 0.38
▸ ALDH1A1 P00352 4/20 0.37
▸ HTT P42858 1/20 0.37
▸ CTSK P43235 1/20 0.37
▸ TRPV4 Q9HBA0 1/20 0.36
▸ DDR1 Q08345 1/20 0.36
▸ KDM4E B2RXH2 2/20 0.36
▸ GAA P10253 1/20 0.36
▸ PDE7A Q13946 1/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.35
▸ MAPK1 P28482 1/20 0.35

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
SCHEMBL26065952 0.92 MEN1 (0.38) MEN1KMT2AHPGDNAMPTALDH1A1
SCHEMBL27070068 0.91 HPGD (0.46) MEN1KMT2AHPGDNAMPTALDH1A1
SCHEMBL27346368 0.89 CTSK (0.39) MEN1KMT2AHPGDALDH1A1CTSK
SCHEMBL27346508 0.89 CTSK (0.39) MEN1KMT2AHPGDALDH1A1CTSK
SCHEMBL25370553 0.87 CTSK (0.37) MEN1KMT2AHPGDALDH1A1CTSK
SCHEMBL25371880 0.86 CTSK (0.37) MEN1KMT2AHPGDCTSKDDR1
SCHEMBL26066123 0.84 EBP (0.41) CTSK
SCHEMBL25370750 0.84 CTSK (0.37) MEN1KMT2AHPGDALDH1A1CTSK
SCHEMBL25370768 0.84 CTSK (0.37) MEN1KMT2AHPGDALDH1A1CTSK
SCHEMBL26065421 0.83 HPGD (0.37) MEN1KMT2AHPGDNAMPTALDH1A1

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-2023164063-A1 EMOPAMIL-BINDING PROTEIN INHIBITORS AND USES THEREOF BIOGEN MA INC. (US) 2023-08-31 — — WO disclosed
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