SCHEMBL11286508

SCHEMBL11286508

CCOC(=O)CN/C(C)=C(/C)C(=O)OCC

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 3/20 0.50
MGAM O43451 1/20 0.46
SI P14410 1/20 0.46
MGAM2 Q2M2H8 1/20 0.46
EGLN1 Q9GZT9 1/20 0.44
PPID Q08752 3/20 0.41
SMN1; SMN2 Q16637 3/20 0.41
ALDH1A1 P00352 6/20 0.41
MAPT P10636 2/20 0.41
TSHR P16473 1/20 0.41
POLB P06746 1/20 0.40
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
HPGD P15428 1/20 0.40
PPIB P23284 1/20 0.40
PPIA P62937 1/20 0.40
PPIG Q13427 1/20 0.40
TRPA1 O75762 1/20 0.39
EPHX2 P34913 1/20 0.39
GLO1 Q04760 1/20 0.38

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
SCHEMBL11286533 1.00 GAA (0.50) GAAMGAMSIMGAM2EGLN1
SCHEMBL7089973 0.79 GAA (0.61) GAAMGAMSIMGAM2EGLN1
SCHEMBL5854855 0.78 EGLN1 (0.70) GAAMGAMSIMGAM2EGLN1
SCHEMBL48270 0.77 GAA (0.59) GAAMGAMSIMGAM2PPID
SCHEMBL27434109 0.77 GAA (0.59) GAAMGAMSIMGAM2EGLN1
SCHEMBL28036731 0.75 ALDH1A1 (0.44) GAAMGAMSIMGAM2EGLN1
SCHEMBL7946756 0.74 PPID (0.62) GAAMGAMSIMGAM2PPID
SCHEMBL3409989 0.74 MAPT (0.47) GAAMGAMSIMGAM2EGLN1
SCHEMBL11180930 0.74 TET2 (0.59) GAAMGAMSIMGAM2EGLN1
SCHEMBL5656847 0.74 MAPT (0.47) GAAMGAMSIMGAM2EGLN1

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
US-4315939-A Piperidine derivatives of 4,5-dialkyl-3-hydroxy-pyrrole-2-carboxylic acid esters, pharmaceutical formulations containing these compounds and use in treating cardiac arrhythmias BASF AKTIENGESELLSCHAFT (DE) 1982-02-16 US disclosed