SCHEMBL30829581

SCHEMBL30829581

CCOC(=O)c1ccccc1OCCCNC(=O)OCc1ccccc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 4/20 0.59
MAPT P10636 1/20 0.59
HTT P42858 2/20 0.54
LMNA P02545 1/20 0.53
SMN1; SMN2 Q16637 1/20 0.53
TSHR P16473 2/20 0.53
ALDH1A1 P00352 1/20 0.53
CYP3A4 P08684 1/20 0.53
MAPK1 P28482 1/20 0.53
TDP1 Q9NUW8 1/20 0.53
TGM2 P21980 1/20 0.49
KEAP1 Q14145 2/20 0.48
NFE2L2 Q16236 2/20 0.48
HDAC3 O15379 1/20 0.48
HDAC4 P56524 1/20 0.48
HDAC1 Q13547 1/20 0.48
HDAC7 Q8WUI4 1/20 0.48
HDAC2 Q92769 1/20 0.48
HDAC10 Q969S8 1/20 0.48
HDAC11 Q96DB2 1/20 0.48

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
SCHEMBL30829605 0.95 L3MBTL1 (0.54) L3MBTL1MAPTHTTLMNASMN1; SMN2
SCHEMBL30829521 0.91 L3MBTL1 (0.57) L3MBTL1MAPTHTTLMNASMN1; SMN2
SCHEMBL24627828 0.87 L3MBTL1 (0.62) L3MBTL1MAPTHTTLMNASMN1; SMN2
SCHEMBL1821875 0.83 ALDH1A1 (0.55) L3MBTL1MAPTHTTLMNASMN1; SMN2
SCHEMBL29777983 0.83 LMNA (0.65) L3MBTL1MAPTHTTLMNASMN1; SMN2
SCHEMBL11323227 0.82 TSHR (0.76) L3MBTL1MAPTHTTLMNASMN1; SMN2
SCHEMBL15603426 0.81 TSHR (0.70) L3MBTL1MAPTHTTLMNASMN1; SMN2
SCHEMBL11421173 0.81 ALDH1A1 (0.65) L3MBTL1MAPTHTTLMNASMN1; SMN2
SCHEMBL27898281 0.81 L3MBTL1 (0.66) L3MBTL1HTTSMN1; SMN2TSHRALDH1A1
SCHEMBL340937 0.81 HTT (0.69) L3MBTL1MAPTHTTSMN1; SMN2TSHR

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