SCHEMBL14624176

SCHEMBL14624176

CCCC(=O)Nc1ccc(N2CCN(CCC3CCNCC3)CC2)cc1

nearest known ligand 0.58

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.58
NPC1 O15118 1/20 0.58
TP53 P04637 1/20 0.58
RAB9A P51151 1/20 0.58
MAPT P10636 6/20 0.58
GAA P10253 2/20 0.56
LMNA P02545 3/20 0.55
RXFP1 Q9HBX9 1/20 0.55
CACNA1G O43497 3/20 0.53
HTT P42858 2/20 0.50
POLB P06746 1/20 0.49
MAPK1 P28482 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
KDM4E B2RXH2 1/20 0.48
DRD2 P14416 1/20 0.47
DRD3 P35462 1/20 0.47
GLA P06280 1/20 0.47
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47

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
SCHEMBL14624913 0.88 LMNA (0.52) SMN1; SMN2MAPTGAALMNARXFP1
SCHEMBL14624173 0.86 GAA (0.48) SMN1; SMN2MAPTGAALMNARXFP1
SCHEMBL4512476 0.86 MAPT (0.60) SMN1; SMN2NPC1TP53RAB9AMAPT
SCHEMBL14624171 0.83 MAPT (0.56) MAPTGAALMNARXFP1CACNA1G
SCHEMBL14624172 0.83 DRD2 (0.53) MAPTGAALMNARXFP1CACNA1G
SCHEMBL14624309 0.82 NAMPT (0.45) SMN1; SMN2MAPTGAALMNARXFP1
SCHEMBL13757761 0.82 MAPT (0.54) SMN1; SMN2NPC1TP53RAB9AMAPT
SCHEMBL14624915 0.80 DRD2 (0.49) MAPTGAALMNARXFP1CACNA1G
Hydrochloric Acid SCHEMBL8479721 0.79 DRD2 (0.50) GAALMNARXFP1CACNA1GDRD2
SCHEMBL6407919 0.78 NPC1 (0.76) SMN1; SMN2NPC1TP53RAB9AMAPT

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
WO-2007003964-A1 G-PROTEIN COUPLED RECEPTOR AGONISTS PROSIDION LIMITED (GB) 2007-01-11 WO disclosed