SCHEMBL1807386

SCHEMBL1807386

CCOC(=O)c1c(C)n[nH]c1-c1ncccc1COC1CC1

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PDE4D Q08499 1/20 0.43
TDP2 O95551 3/20 0.38
MAPK10 P53779 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
HTT P42858 1/20 0.36
AURKA O14965 1/20 0.36
RIPK1 Q13546 1/20 0.36
ELANE P08246 1/20 0.36
EPHX2 P34913 1/20 0.36
KDM4E B2RXH2 3/20 0.36
CASP1 P29466 1/20 0.35
HSD17B10 Q99714 1/20 0.35
ALDH1A1 P00352 2/20 0.35
POLB P06746 1/20 0.35
IDO1 P14902 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
ADORA3 P0DMS8 1/20 0.34
BRD4 O60885 1/20 0.34
SMO Q99835 1/20 0.34

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
SCHEMBL1806748 0.87 PDE4D (0.47) PDE4DTDP2MAPK10SMN1; SMN2HTT
SCHEMBL1808198 0.83 PDE4D (0.43) PDE4DTDP2MAPK10SMN1; SMN2HTT
SCHEMBL1805935 0.82 PDE4D (0.46) PDE4DTDP2MAPK10SMN1; SMN2HTT
SCHEMBL1809756 0.82 PDE4D (0.46) PDE4DTDP2MAPK10SMN1; SMN2HTT
SCHEMBL1808007 0.80 KDM4E (0.34) KDM4EL3MBTL1SMO
SCHEMBL1807745 0.79 PDE4D (0.50) PDE4DTDP2MAPK10SMN1; SMN2HTT
SCHEMBL1806318 0.79 PDE4D (0.50) PDE4DTDP2MAPK10SMN1; SMN2HTT
SCHEMBL1807009 0.77 PDE4D (0.48) PDE4DTDP2MAPK10SMN1; SMN2HTT
SCHEMBL19209480 0.69 PDE4D (0.59) PDE4DMAPK10SMN1; SMN2HTTKDM4E
SCHEMBL1807759 0.69 TDP2 (0.42) PDE4DTDP2MAPK10SMN1; SMN2HTT

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-2501703-A1 SPIROPIPERIDINE COMPOUNDS AS ORL-1 RECEPTOR ANTAGONISTS Eli Lilly and Company (US) 2012-09-26 EP disclosed
WO-2011060035-A1 SPIROPIPERIDINE COMPOUNDS AS ORL-1 RECEPTOR ANTAGONISTS ELI LILLY AND COMPANY (US) 2011-05-19 WO disclosed