SCHEMBL11246705

SCHEMBL11246705

CCCCCN1CCC2(c3cccc(O)c3)CCCC2C1

nearest known ligand 0.80

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
OPRD1 P41143 2/20 0.65
OPRK1 P41145 2/20 0.65
OPRM1 P35372 1/20 0.65
HTR1A P08908 6/20 0.57
DRD1 P21728 6/20 0.57
DRD4 P21917 6/20 0.57
DRD5 P21918 6/20 0.57
DRD3 P35462 6/20 0.57
DRD2 P14416 5/20 0.56

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
SCHEMBL11178955 0.97 OPRM1 (0.70) OPRD1OPRK1OPRM1HTR1ADRD1
SCHEMBL11178963 0.97 OPRM1 (0.70) OPRD1OPRK1OPRM1HTR1ADRD1
SCHEMBL11194604 0.96 OPRM1 (0.69) OPRD1OPRK1OPRM1HTR1ADRD1
SCHEMBL11194601 0.96 OPRM1 (0.69) OPRD1OPRK1OPRM1HTR1ADRD1
SCHEMBL11244026 0.92 OPRD1 (0.69) OPRD1OPRK1OPRM1DRD4DRD3
Bromide SCHEMBL11247569 0.91 OPRD1 (0.67) OPRD1OPRK1OPRM1DRD4DRD3
SCHEMBL11258195 0.86 SLC6A4 (0.61) OPRD1OPRK1OPRM1DRD2
Bromide SCHEMBL11248188 0.85 SLC6A2 (0.50) OPRD1OPRK1OPRM1
Bromide SCHEMBL11265180 0.85 SLC6A4 (0.60) OPRD1OPRK1OPRM1DRD2
Bromide SCHEMBL11247155 0.84 SLC6A4 (0.59) OPRD1OPRK1OPRM1DRD2

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-4337341-A 4a-Aryl-octahydro-1H-2-pyrindines ELI LILLY AND COMPANY (US) 1982-06-29 US disclosed