SCHEMBL3260783

SCHEMBL3260783

CN1CCc2ccccc2[C@H](c2ccccc2)CC1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRCP P42785 2/20 0.57
SLC6A2 P23975 1/20 0.57
SLC6A4 P31645 1/20 0.57
SLC6A3 Q01959 1/20 0.57
DRD1 P21728 6/20 0.54
HTR2A P28223 1/20 0.54
SIGMAR1 Q99720 4/20 0.51
MAPK1 P28482 1/20 0.51
THPO P40225 1/20 0.51
HIF1A Q16665 1/20 0.51
HSD17B10 Q99714 1/20 0.51
MTOR P42345 1/20 0.51
KDM4E B2RXH2 1/20 0.50
MAPT P10636 1/20 0.50
BLM P54132 1/20 0.50
PMP22 Q01453 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
DRD2 P14416 1/20 0.50
CYP3A4 P08684 1/20 0.49
CYP2D6 P10635 1/20 0.49

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
SCHEMBL3260780 1.00 PRCP (0.57) PRCPSLC6A2SLC6A4SLC6A3DRD1
SCHEMBL1247171 0.87 SLC6A2 (0.71) SLC6A2SLC6A4SLC6A3HTR2ASMN1; SMN2
SCHEMBL2571100 0.87 SLC6A2 (0.71) SLC6A2SLC6A4SLC6A3DRD1HTR2A
SCHEMBL503849 0.80 SIGMAR1 (0.62) PRCPSLC6A2SLC6A4SLC6A3HTR2A
SCHEMBL29390302 0.80 SIGMAR1 (0.62) PRCPSLC6A2SLC6A4SLC6A3HTR2A
Ammonia Solution, Strong SCHEMBL8210515 0.78 SIGMAR1 (0.60) PRCPSLC6A2SLC6A4SLC6A3HTR2A
SCHEMBL30606845 0.78 SIGMAR1 (0.60) PRCPSLC6A2SLC6A4SLC6A3HTR2A
SCHEMBL28025940 0.78 SIGMAR1 (0.60) PRCPSLC6A2SLC6A4SLC6A3HTR2A
SCHEMBL23677287 0.78 SLC6A2 (0.67) SLC6A2SLC6A4SLC6A3HTR2ASMN1; SMN2
SCHEMBL395087 0.77 GID4 (0.62) SIGMAR1MAPK1BLMCYP3A4CYP2D6

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
WO-2010012812-A1 BENZAZEPINES AND BENZAZOCINES AS SIGMA-RECEPTOR LIGANDES Westfälische Wilhelms Universität Münster (DE) 2010-02-04 WO disclosed