SCHEMBL25935745

SCHEMBL25935745

CCOC(=O)CC(CNC)N(C)C

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.43
MGAM O43451 1/20 0.43
SI P14410 1/20 0.43
MGAM2 Q2M2H8 1/20 0.43
CA12 O43570 1/20 0.37
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
CA9 Q16790 1/20 0.37
ALDH1A1 P00352 6/20 0.36
TRPA1 O75762 1/20 0.36
CYP3A4 P08684 2/20 0.35
ALOX15 P16050 2/20 0.35
TSHR P16473 2/20 0.35
TDP1 Q9NUW8 2/20 0.35
HSD17B10 Q99714 2/20 0.34
CHRM1 P11229 1/20 0.34
ADORA1 P30542 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.33
CYP1A2 P05177 1/20 0.32
CYP2D6 P10635 1/20 0.32

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
SCHEMBL3910325 0.81 MGAM (0.44) GAAMGAMSIMGAM2CA12
SCHEMBL15027504 0.78 MGAM (0.41) GAAMGAMSIMGAM2CA12
SCHEMBL20028538 0.71 MGAM (0.46) GAAMGAMSIMGAM2CA12
SCHEMBL27856391 0.70 GAA (0.42) GAAMGAMSIMGAM2ALDH1A1
SCHEMBL15900030 0.69 MGAM (0.44) GAAMGAMSIMGAM2CA12
SCHEMBL21522897 0.69 MGAM (0.40) GAAMGAMSIMGAM2CA12
SCHEMBL13982564 0.69 GAA (0.54) GAAMGAMSIMGAM2ALDH1A1
SCHEMBL13397769 0.68 OPRD1 (0.36)
SCHEMBL13205142 0.68 MGAM (0.43) GAAMGAMSIMGAM2CA12
SCHEMBL7835239 0.67 GAA (0.52) GAAMGAMSIMGAM2ALDH1A1

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-4218722-A2 BIODEGRADABLE LIPIDS FOR THE DELIVERY OF ACTIVE AGENTS Alnylam Pharmaceuticals, Inc. (US) 2023-08-02 EP disclosed