SCHEMBL8892949

SCHEMBL8892949

OC(CCN1CCC(Cc2ccc(F)cc2)CC1)c1ccccc1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRIN2B Q13224 3/20 0.71
GRIN1 Q05586 2/20 0.71
GRIN2D O15399 1/20 0.71
GRIN3B O60391 1/20 0.71
ADRA1D P25100 1/20 0.71
ADRA1A P35348 1/20 0.71
ADRA1B P35368 1/20 0.71
GRIN2A Q12879 1/20 0.71
GRIN2C Q14957 1/20 0.71
GRIN3A Q8TCU5 1/20 0.71
MEN1 O00255 1/20 0.64
KMT2A Q03164 1/20 0.64
HTR1A P08908 1/20 0.63
SLC6A4 P31645 5/20 0.62
SLC6A3 Q01959 5/20 0.62
SLC6A2 P23975 3/20 0.62
GMNN O75496 1/20 0.61
TP53 P04637 1/20 0.61
CYP3A4 P08684 1/20 0.61
ALOX15 P16050 1/20 0.61

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
SCHEMBL6215029 0.91 GRIN2B (0.85) GRIN2BGRIN1GRIN2DGRIN3BADRA1D
Hydrochloric Acid SCHEMBL467351 0.88 GRIN1 (0.68) GRIN2BGRIN1GRIN2DGRIN3BADRA1D
Hydrochloric Acid SCHEMBL7248616 0.83 GRIN2B (0.55) GRIN2BGRIN1GRIN2DGRIN3BADRA1D
SCHEMBL27447538 0.81 GRIN2B (0.69) GRIN2BGRIN1GRIN2DGRIN3BADRA1D
SCHEMBL6011652 0.79 SLC6A4 (0.62) GRIN2BGRIN1GRIN2DGRIN3BADRA1D
SCHEMBL5777439 0.79 SLC6A4 (0.59) GRIN2BGRIN1GRIN2DGRIN3BADRA1D
SCHEMBL5950353 0.79 SLC6A4 (0.59) GRIN2BGRIN1GRIN2DGRIN3BADRA1D
SCHEMBL6011653 0.79 SLC6A4 (0.62) GRIN2BGRIN1GRIN2DGRIN3BADRA1D
SCHEMBL8814813 0.78 GRIN2D (0.69) GRIN2BGRIN1GRIN2DGRIN3BADRA1D
SCHEMBL6705234 0.78 CCR5 (0.85)

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-1997009310-A1 1-PHENYL-3-4-[BENZYLPIPERIDINYL-1]-PROPANOL-1 DERIVATIVES, PREPARATION THEREOF AND THERAPEUTICAL APPLICATION THEREOF SYNTHELABO (FR) 1997-03-13 WO disclosed