SCHEMBL9533670

SCHEMBL9533670

OC1(c2ccc(Cl)cc2)CCN(CCC2OCCO2)CC1

nearest known ligand 0.60

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 9/20 0.60
OPRM1 P35372 3/20 0.56
OPRL1 P41146 2/20 0.56
CCR3 P51677 2/20 0.55
ADRA1A P35348 1/20 0.54
HTR1A P08908 2/20 0.52
DRD1 P21728 2/20 0.52
DRD5 P21918 2/20 0.52
SLC6A2 P23975 2/20 0.52
HTR2A P28223 2/20 0.52
SLC6A4 P31645 2/20 0.52
HTR7 P34969 2/20 0.52
HRH1 P35367 2/20 0.52
DRD3 P35462 2/20 0.52
HTR2B P41595 2/20 0.52
CCR1 P32246 1/20 0.52

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
SCHEMBL9529535 0.86 DRD2 (0.60) DRD2OPRM1ADRA1AHTR1ADRD1
SCHEMBL9529336 0.86 OPRL1 (0.57) DRD2OPRM1OPRL1CCR3CCR1
SCHEMBL14307260 0.83 CCR3 (0.69) DRD2OPRM1OPRL1CCR3ADRA1A
SCHEMBL8741960 0.81 OPRL1 (0.55) DRD2OPRM1OPRL1CCR3
SCHEMBL10287607 0.79 OPRM1 (0.63) DRD2OPRM1OPRL1CCR3ADRA1A
SCHEMBL9302682 0.77 OPRL1 (0.66) DRD2OPRM1OPRL1CCR3ADRA1A
SCHEMBL1132636 0.75 CCR1 (0.65) DRD2CCR3ADRA1AHTR1ADRD1
SCHEMBL11938907 0.75 DRD2 (0.65) DRD2CCR3ADRA1AHTR1ADRD1
SCHEMBL10610496 0.75 DRD2 (0.65) DRD2CCR3ADRA1AHTR1ADRD1
SCHEMBL7236512 0.74 CCR1 (0.62) DRD2OPRM1OPRL1CCR3ADRA1A

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-0556342-A1 NEW 1-AZABICYCLOALKANE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AND PROCESS FOR PREPARING SAME GYOGYSZERKUTATO INTEZET K.V. (HU) 1993-08-25 EP disclosed
WO-1992007854-A1 NEW 1-AZABICYCLOALKANE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AND PROCESS FOR PREPARING SAME GYÓGYSZERKUTATÓ INTÉZET KV. (HU) 1992-05-14 WO disclosed