SCHEMBL26065637

SCHEMBL26065637

O=S(=O)(c1ccc(C(F)F)nc1C1CC1)N1CCN(C2CCOCC2)CC1

nearest known ligand 0.38

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 5/20 0.38
SMN1; SMN2 Q16637 3/20 0.38
HSD11B1 P28845 1/20 0.38
KMT2A Q03164 4/20 0.36
MEN1 O00255 3/20 0.36
GAA P10253 1/20 0.36
HPGD P15428 1/20 0.36
ALDH1A1 P00352 4/20 0.36
KDM4E B2RXH2 2/20 0.35
MAPK1 P28482 1/20 0.34
USP5 P45974 1/20 0.34
ALOX5AP P20292 1/20 0.34
FEN1 P39748 1/20 0.34

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
SCHEMBL25372846 0.86 MEN1 (0.31) SMN1; SMN2HSD11B1KMT2AMEN1HPGD
SCHEMBL26065298 0.85 NAMPT (0.39) NAMPTSMN1; SMN2HSD11B1KMT2AMEN1
SCHEMBL26065648 0.85 SMN1; SMN2 (0.40) SMN1; SMN2HSD11B1KMT2AMEN1GAA
SCHEMBL26066093 0.83 MEN1 (0.41) NAMPTSMN1; SMN2HSD11B1KMT2AMEN1
SCHEMBL26066130 0.83 NAMPT (0.40) NAMPTSMN1; SMN2HSD11B1KMT2AMEN1
SCHEMBL26065642 0.80 CYP3A4 (0.40) SMN1; SMN2KMT2AMEN1ALDH1A1KDM4E
SCHEMBL25374315 0.75 TLR9 (0.31) ALOX5APFEN1
SCHEMBL26065530 0.75 HSD11B1 (0.39) NAMPTSMN1; SMN2HSD11B1KMT2AMEN1
SCHEMBL26065641 0.74 TGM2 (0.46)
SCHEMBL26065410 0.73 ALDH1A1 (0.37) NAMPTSMN1; SMN2HSD11B1KMT2AMEN1

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