SCHEMBL7656220

SCHEMBL7656220

CN(C)CCc1ccccc1-n1nc(-c2ccccc2)n(C)c1=O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 4/20 0.40
HTR7 P34969 7/20 0.38
SRC P12931 1/20 0.37
HTR6 P50406 4/20 0.36
HTR1A P08908 3/20 0.36
DRD2 P14416 2/20 0.36
DRD3 P35462 2/20 0.36
LMNA P02545 1/20 0.36
CHRM2 P08172 1/20 0.36
ADRA2A P08913 1/20 0.36
MAPT P10636 1/20 0.36
DRD1 P21728 1/20 0.36
SLC6A2 P23975 1/20 0.36
HTR2A P28223 1/20 0.36
SLC6A4 P31645 1/20 0.36
ADRA1A P35348 1/20 0.36
HRH1 P35367 1/20 0.36
OPRM1 P35372 1/20 0.36
POLB P06746 1/20 0.35
HPGD P15428 1/20 0.34

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
SCHEMBL7660359 0.85 MGLL (0.44) LMNAMAPTOPRM1HPGDADORA2A
Dimethylamine SCHEMBL7656223 0.82 MGLL (0.41) LMNAMAPTOPRM1HPGDADORA2A
SCHEMBL7656105 0.80 DRD2 (0.39) HTR7HTR6HTR1ADRD2DRD3
SCHEMBL7655906 0.79 POLB (0.41) TAAR1HTR7HTR6HTR1ADRD2
SCHEMBL7659194 0.77 ALDH1A1 (0.51) MAPTOPRM1POLBHPGDADORA2A
SCHEMBL7658070 0.74 NPC1 (0.44)
SCHEMBL7652394 0.74 HSD11B1 (0.45) OPRM1POLBHPGDADORA2AADORA2B
SCHEMBL7652883 0.74 OPRM1 (0.41) HTR1AOPRM1HPGDADORA2AADORA2B
SCHEMBL7652938 0.73 ALDH1A1 (0.43) HTR7HTR6HTR1ADRD2DRD3
SCHEMBL7656052 0.72 ADORA1 (0.54) MAPTADRA1AADORA2A

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
US-6492407-B2 NEUROPROTECTIVE ACTIVITY BOEHRINGER IMGELHEIM PHARMA KG (DE) 2002-12-10 US disclosed