SCHEMBL4033065

SCHEMBL4033065

CCOC(=O)CC(C)C1CCN(C(=O)O)CC1

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.41
GAA P10253 2/20 0.41
ALDH1A1 P00352 6/20 0.40
CYP2D6 P10635 1/20 0.40
THRB P10828 1/20 0.38
ATM Q13315 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
LMNA P02545 1/20 0.38
KDM4E B2RXH2 1/20 0.36
NOS3 P29474 1/20 0.36
NOS2 P35228 1/20 0.36
TP53 P04637 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
NPC1 O15118 2/20 0.36
RAB9A P51151 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
HPGD P15428 1/20 0.36
TSHR P16473 1/20 0.36
NPY2R P49146 1/20 0.36

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
SCHEMBL19554714 1.00 MAPT (0.41) MAPTGAAALDH1A1CYP2D6THRB
SCHEMBL21557883 0.86 MGAM (0.35) MAPTGAAALDH1A1CYP2D6LMNA
SCHEMBL21821549 0.85 MGAM (0.43) MAPTGAAALDH1A1CYP2D6L3MBTL1
SCHEMBL26077265 0.82 CYP2D6 (0.44) GAAALDH1A1CYP2D6THRBATM
SCHEMBL1295911 0.82 CPN1 (0.41) ALDH1A1
SCHEMBL19554688 0.81 GPR119 (0.50) MAPTGAAALDH1A1L3MBTL1KDM4E
SCHEMBL1575174 0.81 GPR119 (0.50) MAPTGAAALDH1A1L3MBTL1KDM4E
SCHEMBL1866738 0.80 CYP2D6 (0.47) GAAALDH1A1CYP2D6THRBATM
SCHEMBL16530180 0.79 MAPT (0.44) MAPTGAAALDH1A1CYP2D6THRB
SCHEMBL784840 0.79 GAA (0.44) MAPTGAAALDH1A1THRBATM

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-2013201-A1 HETEROCYCLIC GPCR AGONISTS Prosidion Limited (GB) 2009-01-14 EP disclosed
WO-2007116229-A1 HETEROCYCLIC GPCR AGONISTS PROSIDION LIMITED (GB) 2007-10-18 WO disclosed