SCHEMBL1729147

SCHEMBL1729147

NC(=O)CN(CCN1CCN(c2ccc(-c3ccc(Cl)cc3)cn2)CC1)C(=O)O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 2/20 0.43
DRD4 P21917 7/20 0.43
HTR1A P08908 4/20 0.43
HTR2A P28223 4/20 0.43
DRD3 P35462 4/20 0.43
SLC6A4 P31645 2/20 0.43
DRD2 P14416 6/20 0.42
HTR2C P28335 3/20 0.42
HTR7 P34969 3/20 0.42
TMEM97 Q5BJF2 3/20 0.42
SIGMAR1 Q99720 3/20 0.42
AOC3 Q16853 1/20 0.41
AURKA O14965 2/20 0.41
AURKB Q96GD4 2/20 0.41
KDR P35968 1/20 0.41
EGLN1 Q9GZT9 1/20 0.40
CNR2 P34972 1/20 0.39
RAB9A P51151 1/20 0.39
ME2 P23368 1/20 0.38
ME1 P48163 1/20 0.38

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
SCHEMBL1727880 0.89 CNR2 (0.50) MGLLDRD4HTR1AHTR2ADRD3
SCHEMBL1728997 0.87 DRD2 (0.42) MGLLDRD4HTR1AHTR2ADRD3
SCHEMBL1727895 0.87 EGLN1 (0.43) DRD4HTR1AHTR2ADRD3SLC6A4
SCHEMBL1729278 0.87 HTR1A (0.41) DRD4HTR1AHTR2ADRD3SLC6A4
SCHEMBL1729017 0.85 DRD3 (0.42) DRD4HTR1AHTR2ADRD3SLC6A4
SCHEMBL1729061 0.84 DGAT1 (0.46) MGLLAOC3EGLN1CNR2DGAT1
SCHEMBL1728979 0.82 HTR1A (0.43) DRD4HTR1AHTR2ADRD3DRD2
SCHEMBL1730270 0.81 EGLN1 (0.47) DRD4HTR1AHTR2ADRD3SLC6A4
SCHEMBL1730237 0.81 MCHR1 (0.44) DRD4HTR1AHTR2ADRD3SLC6A4
SCHEMBL1728819 0.80 SLC6A7 (0.43) MGLLDRD4HTR1AHTR2ADRD3

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
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 claimed