SCHEMBL11262849

SCHEMBL11262849

CCCN1CCC2(c3cccc(OC)c3)CCCC2C1

nearest known ligand 0.69

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 7/20 0.65
SLC6A2 P23975 5/20 0.61
SLC6A3 Q01959 5/20 0.61
DRD2 P14416 3/20 0.55
OPRM1 P35372 1/20 0.50
OPRD1 P41143 1/20 0.50
OPRK1 P41145 1/20 0.50
KDM2B Q8NHM5 1/20 0.50
SOAT1 P35610 1/20 0.43
CYP2D6 P10635 2/20 0.43
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
SMN1; SMN2 Q16637 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
SCHEMBL11258195 0.92 SLC6A4 (0.61) SLC6A4SLC6A2SLC6A3DRD2OPRM1
Bromide SCHEMBL11265180 0.91 SLC6A4 (0.60) SLC6A4SLC6A2SLC6A3DRD2OPRM1
Bromide SCHEMBL11247155 0.91 SLC6A4 (0.59) SLC6A4SLC6A2SLC6A3DRD2OPRM1
SCHEMBL11191207 0.89 SLC6A4 (0.62) SLC6A4SLC6A2SLC6A3DRD2OPRM1
SCHEMBL11191206 0.89 SLC6A4 (0.62) SLC6A4SLC6A2SLC6A3DRD2OPRM1
SCHEMBL11194278 0.88 SLC6A4 (0.61) SLC6A4SLC6A2SLC6A3DRD2OPRM1
SCHEMBL11194276 0.88 SLC6A4 (0.61) SLC6A4SLC6A2SLC6A3DRD2OPRM1
SCHEMBL11246210 0.87 SLC6A4 (0.58) SLC6A4SLC6A2SLC6A3DRD2OPRM1
SCHEMBL11249000 0.86 SLC6A4 (0.79) SLC6A4SLC6A2SLC6A3OPRM1OPRD1
SCHEMBL11248997 0.86 SLC6A4 (0.79) SLC6A4SLC6A2SLC6A3OPRM1OPRD1

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