SCHEMBL7425816

SCHEMBL7425816

CCCCOC(=O)N1CCC(O)(c2ccc(Cc3ccc(F)cc3)cc2)CC1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.45
OPRD1 P41143 2/20 0.44
OPRK1 P41145 1/20 0.44
CHRM4 P08173 1/20 0.44
DRD2 P14416 6/20 0.43
DRD3 P35462 3/20 0.43
HRH1 P35367 3/20 0.43
HTR1A P08908 2/20 0.43
DRD1 P21728 2/20 0.43
DRD5 P21918 2/20 0.43
SLC6A2 P23975 2/20 0.43
HTR2A P28223 2/20 0.43
SLC6A4 P31645 2/20 0.43
HTR7 P34969 2/20 0.43
HTR2B P41595 2/20 0.43
DRD4 P21917 1/20 0.43
LMNA P02545 1/20 0.42
POLB P06746 1/20 0.42
HRH2 P25021 1/20 0.41
S1PR2 O95136 1/20 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
SCHEMBL16244844 0.82 CCR1 (0.49) SMN1; SMN2OPRD1OPRK1CHRM4DRD2
SCHEMBL23112637 0.82 LMNA (0.43) SMN1; SMN2OPRD1OPRK1DRD2DRD3
SCHEMBL3045886 0.81 CNR1 (0.49) SMN1; SMN2DRD2DRD3DRD4S1PR2
SCHEMBL17009523 0.80 KMT2A (0.46) SMN1; SMN2OPRD1OPRK1DRD2DRD3
SCHEMBL7478597 0.79 MEN1 (0.48) SMN1; SMN2OPRD1OPRK1CHRM4DRD2
SCHEMBL19212251 0.77 OPRD1 (0.43) SMN1; SMN2OPRD1OPRK1CHRM4HRH1
SCHEMBL7422101 0.77 CHRM4 (0.45) SMN1; SMN2OPRD1OPRK1CHRM4HRH1
SCHEMBL7485189 0.76 CCR1 (0.45) OPRD1OPRK1DRD2DRD3HRH1
SCHEMBL8696969 0.75 RORC (0.58) SMN1; SMN2OPRD1OPRK1CHRM4DRD2
SCHEMBL7511921 0.74 POLB (0.52) SMN1; SMN2CHRM4LMNAPOLBL3MBTL1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0958280-A1 ARYLPIPERIDINOPROPANOL AND ARYLPIPERAZINOPROPANOL DERIVATIVES AND PHARMACEUTICALS CONTAINING THE SAME SUNTORY LIMITED (JP) 1999-11-24 EP disclosed
WO-1999023072-A1 ARYLPIPERIDINOPROPANOL AND ARYLPIPERAZINOPROPANOL DERIVATIVES AND PHARMACEUTICALS CONTAINING THE SAME SUNTORY LIMITED (JP) 1999-05-14 WO disclosed