SCHEMBL8744422

SCHEMBL8744422

CCCCCCCCCCCCN1CCC(C(C)(C)C(=O)NCC)CC1

nearest known ligand 0.50

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
BCHE P06276 5/20 0.50
GNAO1 P09471 9/20 0.49
GNAI3 P08754 8/20 0.49
GNAI1 P63096 8/20 0.49
KCNH2 Q12809 1/20 0.44
CCR1 P32246 1/20 0.39

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
SCHEMBL8744405 0.90 GNAO1 (0.48) BCHEGNAO1GNAI3GNAI1KCNH2
SCHEMBL8744379 0.87 GNAO1 (0.50) BCHEGNAO1GNAI3GNAI1KCNH2
SCHEMBL8744360 0.84 GNAO1 (0.47) BCHEGNAO1GNAI3GNAI1KCNH2
SCHEMBL8872700 0.82 GNAO1 (0.54) BCHEGNAO1GNAI3GNAI1KCNH2
SCHEMBL8744425 0.82 KCNH2 (0.53) KCNH2CCR1
SCHEMBL8744456 0.81 GNAO1 (0.57) BCHEGNAO1GNAI3GNAI1KCNH2
SCHEMBL19022018 0.81 KMT2A (0.37) BCHEGNAO1GNAI3GNAI1
SCHEMBL8744403 0.79 GNAO1 (0.50) BCHEGNAO1GNAI3GNAI1KCNH2
SCHEMBL8744343 0.78 BCHE (0.50) BCHEGNAO1GNAI3GNAI1KCNH2
SCHEMBL8744477 0.77 GNAO1 (0.44) BCHEGNAO1GNAI3GNAI1KCNH2

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