SCHEMBL8744456

SCHEMBL8744456

CCCCCCCCCCCCN1CCC(C(C)(C)C(N)=O)CC1

nearest known ligand 0.57

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GNAO1 P09471 9/20 0.57
GNAI3 P08754 8/20 0.57
GNAI1 P63096 8/20 0.57
BCHE P06276 5/20 0.50
KCNH2 Q12809 1/20 0.47
SPHK1 Q9NYA1 1/20 0.40

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
SCHEMBL8872700 0.86 GNAO1 (0.54) GNAO1GNAI3GNAI1BCHEKCNH2
SCHEMBL8744379 0.82 GNAO1 (0.50) GNAO1GNAI3GNAI1BCHEKCNH2
SCHEMBL8744403 0.82 GNAO1 (0.50) GNAO1GNAI3GNAI1BCHEKCNH2
SCHEMBL8744343 0.81 BCHE (0.50) GNAO1GNAI3GNAI1BCHEKCNH2
SCHEMBL8744422 0.81 BCHE (0.50) GNAO1GNAI3GNAI1BCHEKCNH2
SCHEMBL10152356 0.80 SMN1; SMN2 (0.56)
SCHEMBL8744405 0.80 GNAO1 (0.48) GNAO1GNAI3GNAI1BCHEKCNH2
SCHEMBL8744360 0.79 GNAO1 (0.47) GNAO1GNAI3GNAI1BCHEKCNH2
SCHEMBL22677566 0.79 GNAO1 (0.59) GNAO1GNAI3GNAI1KCNH2
SCHEMBL26748939 0.79 GNAO1 (0.59) GNAO1GNAI3GNAI1KCNH2

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5614534-A Derivatives of β, β-dimethyl-4-piperidineethanamine as inhibitors of the cholesterol biosynthesis FOURNIER INDUSTRIE ET SANTE (FR) 1997-03-25 US disclosed
EP-0699187-B1 BETA,BETA-DIMETHYL-4-PIPERIDINEETHANAMINE DERIVATIVES AS INHIBITORS OF THE CHOLESTEROL BIOSYNTHESIS FOURNIER IND & SANTE (FR) 1997-01-22 EP disclosed
EP-0699187-A1 DERIVATIVES OF -g(b), -g(b)-DIMETHYL-4-PIPERIDINEETHANAMINE AS INHIBITORS OF THE CHOLESTEROL BIOSYNTHESIS FOURNIER IND & SANTE (FR) 1996-03-06 EP disclosed
WO-1994026713-A1 DERIVATIVES OF β, β-DIMETHYL-4-PIPERIDINEETHANAMINE AS INHIBITORS OF THE CHOLESTEROL BIOSYNTHESIS FOURNIER INDUSTRIE ET SANTE (FR) 1994-11-24 WO disclosed