SCHEMBL5554376

SCHEMBL5554376

CCCNC1CCN(CC2CC2)CC1

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ACHE P22303 1/20 0.41
CHRM5 P08912 1/20 0.38
ADRA2C P18825 1/20 0.38
AXL P30530 1/20 0.34
FLT3 P36888 1/20 0.34
TYRO3 Q06418 1/20 0.34
MERTK Q12866 1/20 0.34
GAS6 Q14393 1/20 0.34
GNAI3 P08754 2/20 0.33
GNAO1 P09471 2/20 0.33
GNAI1 P63096 2/20 0.33
DRD4 P21917 1/20 0.33
DRD3 P35462 1/20 0.33
CARM1 Q86X55 1/20 0.33
PRMT6 Q96LA8 1/20 0.33
CYP3A4 P08684 1/20 0.33
HTR4 Q13639 1/20 0.33
SMYD3 Q9H7B4 1/20 0.33
VCP P55072 1/20 0.33

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
SCHEMBL24925450 0.87 ACHE (0.35) ACHECHRM5ADRA2CAXLFLT3
SCHEMBL12464451 0.84 ACHE (0.44) ACHECHRM5ADRA2C
SCHEMBL25575295 0.82 SMN1; SMN2 (0.39) GNAI3GNAO1GNAI1DRD4DRD3
SCHEMBL20492763 0.80 PABPC1 (0.45) GNAI3GNAO1GNAI1CARM1PRMT6
SCHEMBL4623536 0.75 MEN1 (0.43) GNAI3GNAO1GNAI1DRD4DRD3
SCHEMBL2842528 0.75 ACHE (0.47) ACHECHRM5ADRA2C
SCHEMBL24793522 0.74 BACE1 (0.37) ACHEDRD4DRD3
SCHEMBL13654287 0.74 GNAI3 (0.36) ADRA2CGNAI3GNAO1GNAI1DRD4
SCHEMBL5909386 0.73 GNAI3 (0.45) ADRA2CGNAI3GNAO1GNAI1DRD4
SCHEMBL1678882 0.73

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-2006089076-A9 THIAZOLE AMIDES, IMIDAZOLE AMIDES AND RELATED ANALOGUES NEUROGEN CORP (US) 2007-04-26 WO disclosed