SCHEMBL30829554

SCHEMBL30829554

O=C(NCCOc1ccccc1CBr)OCc1ccccc1

nearest known ligand 0.62

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.62
SMN1; SMN2 Q16637 1/20 0.62
L3MBTL1 Q9Y468 2/20 0.58
MAPT P10636 1/20 0.57
HTT P42858 1/20 0.52
TGM2 P21980 1/20 0.47
KEAP1 Q14145 2/20 0.46
NFE2L2 Q16236 2/20 0.46
HRH1 P35367 2/20 0.45
KDM4E B2RXH2 3/20 0.44
TDP1 Q9NUW8 2/20 0.44
SLC1A3 P43003 1/20 0.44
SLC1A1 P43005 1/20 0.44
KCNA5 P22460 1/20 0.44
MEN1 O00255 1/20 0.44
KMT2A Q03164 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
SCHEMBL30829577 0.96 HTT (0.58) LMNASMN1; SMN2L3MBTL1MAPTHTT
SCHEMBL30829559 0.88 LMNA (0.63) LMNASMN1; SMN2L3MBTL1MAPTHTT
SCHEMBL30829556 0.85 HTT (0.59) LMNASMN1; SMN2L3MBTL1MAPTHTT
SCHEMBL30829589 0.84 LMNA (0.65) LMNASMN1; SMN2L3MBTL1MAPTHTT
SCHEMBL3952102 0.83 LMNA (0.67) LMNASMN1; SMN2L3MBTL1MAPTHTT
SCHEMBL29777983 0.82 LMNA (0.65) LMNASMN1; SMN2L3MBTL1MAPTHTT
SCHEMBL30829573 0.80 TGM2 (0.57) LMNASMN1; SMN2L3MBTL1MAPTHTT
SCHEMBL6630507 0.80 LMNA (0.56) LMNASMN1; SMN2L3MBTL1MAPTHTT
SCHEMBL3811564 0.79 L3MBTL1 (0.80) LMNASMN1; SMN2L3MBTL1MAPTHTT
SCHEMBL24627828 0.79 L3MBTL1 (0.62) LMNASMN1; SMN2L3MBTL1MAPTHTT

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4590673-A1 FLUORESCENT PROBES FOR MAGL F. Hoffmann-La Roche AG (CH) 2025-07-30 EP disclosed
WO-2024061853-A1 FLUORESCENT PROBES FOR MAGL F. HOFFMANN-LA ROCHE AG (CH) 2024-03-28 WO disclosed