SCHEMBL1728700

SCHEMBL1728700

CN(C(=O)O)C1CCN(c2nccc3ccccc23)CC1

nearest known ligand 0.54

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HRH4 Q9H3N8 1/20 0.54
HTR2C P28335 1/20 0.51
HCAR2 Q8TDS4 1/20 0.48
MALT1 Q9UDY8 1/20 0.48
SORD Q00796 2/20 0.47
DPP4 P27487 1/20 0.46
DPP7 Q9UHL4 1/20 0.46
DRD2 P14416 1/20 0.42
DRD3 P35462 1/20 0.42
ACACB O00763 1/20 0.41
KMT2A Q03164 1/20 0.41
PHGDH O43175 1/20 0.41

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
SCHEMBL1729150 0.82 HRH4 (0.48) HRH4HTR2CHCAR2MALT1SORD
SCHEMBL18980472 0.78 ADRB2 (0.51) DPP4DRD2DRD3KMT2A
SCHEMBL4582824 0.78 HCAR2 (0.48) HRH4HTR2CHCAR2MALT1SORD
SCHEMBL1267034 0.77 MEN1 (0.52) KMT2A
SCHEMBL2123974 0.77 MEN1 (0.48) KMT2A
SCHEMBL27902619 0.76 ACACB (0.46) HRH4SORDACACB
SCHEMBL1728699 0.76 HRH4 (0.51) HRH4HTR2CHCAR2MALT1SORD
SCHEMBL239313 0.75 HRH4 (0.46) HRH4HTR2CHCAR2MALT1SORD
SCHEMBL237050 0.75 HTR2C (0.64) HRH4HTR2CSORD
SCHEMBL4015416 0.74 HRH4 (0.63) HRH4HTR2CHCAR2MALT1SORD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1633735-B1 DERIVATIVES OF PIPERIDINYL- AND PIPERAZINYL-ALKYL CARBAMATES, PREPARATION METHODS THEREOF AND APPLICATION OF SAME IN THERAPEUTICS SANOFI SA (FR) 2011-11-30 EP disclosed
EP-1633735-A1 DERIVATIVES OF PIPERIDINYL- AND PIPERAZINYL-ALKYL CARBAMATES, PREPARATION METHODS THEREOF AND APPLICATION OF SAME IN THERAPEUTICS Sanofi-Aventis (FR) 2006-03-15 EP disclosed
WO-2004099176-A1 DERIVATIVES OF PIPERIDINYL- AND PIPERAZINYL-ALKYL CARBAMATES, PREPARATION METHODS THEREOF AND APPLICATION OF SAME IN THERAPEUTICS SANOFI-AVENTIS (FR) 2004-11-18 WO disclosed