SCHEMBL8320341

SCHEMBL8320341

[CH2]N1CCN(c2ccc(C)c(C)c2)CC1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADRB1 P08588 1/20 0.61
MAPT P10636 4/20 0.55
GAA P10253 2/20 0.55
ALDH1A1 P00352 3/20 0.45
GFER P55789 1/20 0.45
RAD52 P43351 1/20 0.45
TSHR P16473 2/20 0.44
HTT P42858 2/20 0.44
SMN1; SMN2 Q16637 3/20 0.43
NPSR1 Q6W5P4 1/20 0.43
CNR1 P21554 1/20 0.43
CNR2 P34972 1/20 0.43
DRD4 P21917 3/20 0.43
HTR1A P08908 1/20 0.43
ADRA2C P18825 1/20 0.43
HTR2A P28223 1/20 0.43
HTR7 P34969 1/20 0.42
DRD2 P14416 1/20 0.42
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 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
SCHEMBL8318822 0.85 MAPT (0.62) ADRB1MAPTALDH1A1GFERHTT
SCHEMBL8320347 0.82 ADRB1 (0.63) ADRB1MAPTGAAALDH1A1GFER
SCHEMBL24140572 0.81 ADRB1 (0.68) ADRB1MAPTGAAALDH1A1GFER
SCHEMBL3539353 0.81 ADRB1 (0.68) ADRB1MAPTGAAALDH1A1GFER
SCHEMBL10702610 0.80 ADRB1 (0.61) ADRB1MAPTGAAALDH1A1GFER
SCHEMBL8390975 0.79 ADRB1 (0.66) ADRB1MAPTGAAALDH1A1GFER
SCHEMBL22818552 0.79 ADRB1 (0.66) ADRB1MAPTGAAALDH1A1GFER
SCHEMBL2021224 0.78 MAPT (0.66) ADRB1MAPTGAAALDH1A1GFER
SCHEMBL25787603 0.78 MAPT (0.61) ADRB1MAPTGAAALDH1A1GFER
SCHEMBL13153256 0.77 ADRB1 (0.58) ADRB1MAPTGAAALDH1A1GFER

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-5945421-A TREATING PSYCHOSIS AND SCHIZOPHRENIA WARNER-LAMBERT COMPANY (US) 1999-08-31 US disclosed