SCHEMBL17635429

SCHEMBL17635429

CCOC(=O)NCCCOC(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C

nearest known ligand 0.62

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.62
RXFP1 Q9HBX9 4/20 0.58
MAPK1 P28482 2/20 0.58
TP53 P04637 2/20 0.58
NPSR1 Q6W5P4 1/20 0.55
ADORA2B P29275 2/20 0.54
TSHR P16473 1/20 0.53
L3MBTL1 Q9Y468 2/20 0.52
MAPT P10636 1/20 0.52
TDP1 Q9NUW8 1/20 0.52
LMNA P02545 1/20 0.51
RAB9A P51151 1/20 0.51
MEN1 O00255 1/20 0.51
KMT2A Q03164 1/20 0.51

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
SCHEMBL12686387 0.87 MAPT (0.56) SMN1; SMN2RXFP1MAPK1TP53ADORA2B
SCHEMBL15396540 0.85 SMN1; SMN2 (0.70) SMN1; SMN2RXFP1MAPK1TP53NPSR1
SCHEMBL12260494 0.85 SMN1; SMN2 (0.76) SMN1; SMN2RXFP1MAPK1TP53NPSR1
SCHEMBL25293608 0.83 SMN1; SMN2 (0.70) SMN1; SMN2RXFP1MAPK1TP53NPSR1
SCHEMBL12686356 0.82 SMN1; SMN2 (0.68) SMN1; SMN2RXFP1MAPK1TP53NPSR1
SCHEMBL12260499 0.78 RXFP1 (0.73) SMN1; SMN2RXFP1MAPK1TP53ADORA2B
SCHEMBL10178027 0.78 SMN1; SMN2 (1.00) SMN1; SMN2RXFP1MAPK1TP53NPSR1
SCHEMBL17744968 0.77 RXFP1 (0.75) SMN1; SMN2RXFP1MAPK1TP53ADORA2B
SCHEMBL10850696 0.77 SMN1; SMN2 (0.82) SMN1; SMN2RXFP1MAPK1TP53NPSR1
SCHEMBL12260301 0.76 RXFP1 (0.71) SMN1; SMN2RXFP1MAPK1TP53ADORA2B

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-9296691-B2 Inhibitors of p75 receptor and their uses HORACIO URI SARAGOVI (CA) 2016-03-29 US disclosed