SCHEMBL9729233

SCHEMBL9729233

CCOC(=O)CC(C(=O)OCC)N1CC1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.53
NPSR1 Q6W5P4 2/20 0.53
L3MBTL1 Q9Y468 2/20 0.53
MAPK1 P28482 1/20 0.53
CYP2D6 P10635 1/20 0.42
MGAM O43451 1/20 0.41
GAA P10253 1/20 0.41
SI P14410 1/20 0.41
MGAM2 Q2M2H8 1/20 0.41
ALDH1A1 P00352 7/20 0.41
LMNA P02545 2/20 0.41
RAB9A P51151 2/20 0.41
HPGD P15428 1/20 0.41
KMT2A Q03164 1/20 0.41
TSHR P16473 4/20 0.41
CYP3A4 P08684 2/20 0.40
ALOX15 P16050 2/20 0.40
TDP1 Q9NUW8 1/20 0.40
CHRM1 P11229 1/20 0.39
ADORA1 P30542 1/20 0.39

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
SCHEMBL28794446 0.91 MAPT (0.64) MAPTNPSR1L3MBTL1MAPK1CYP2D6
SCHEMBL23376910 0.91 MAPT (0.64) MAPTNPSR1L3MBTL1MAPK1CYP2D6
SCHEMBL7306734 0.88 MAPT (0.47) MAPTNPSR1L3MBTL1MAPK1CYP2D6
SCHEMBL7306746 0.88 MAPT (0.47) MAPTNPSR1L3MBTL1MAPK1CYP2D6
SCHEMBL11858146 0.82 ALDH1A1 (0.44) MAPTNPSR1L3MBTL1MAPK1MGAM
SCHEMBL10726885 0.79 MAPT (0.51) MAPTNPSR1L3MBTL1MAPK1CYP2D6
SCHEMBL10589007 0.78 NPSR1 (0.50) MAPTNPSR1L3MBTL1MAPK1ALDH1A1
SCHEMBL2963859 0.77 CYP2D6 (0.39) MAPTNPSR1L3MBTL1MAPK1CYP2D6
SCHEMBL20399134 0.76 MAPT (0.40) MAPTNPSR1L3MBTL1MAPK1GAA
SCHEMBL11567612 0.74 L3MBTL1 (0.43) MAPTNPSR1L3MBTL1MAPK1MGAM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5093486-A Side effect reduction AKZO N.V. (NL) 1992-03-03 US disclosed
US-4981959-A Modified cellulose for biocompatible dialysis membranes II and process for preparation thereof AKZO N.V. (NL) 1991-01-01 US disclosed
US-4962140-A Process for producing cellulosic dialysis membranes having improved biocompatibility and device for carrying out the process AKZO N.V. (NL) 1990-10-09 US disclosed