SCHEMBL8775666

SCHEMBL8775666

C[C@H](c1ccccc1)N1CC2(CC2)C2(C1)OCCO2

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 1/20 0.47
OPRM1 P35372 3/20 0.43
OPRD1 P41143 3/20 0.43
OPRK1 P41145 3/20 0.43
OPRL1 P41146 3/20 0.43
MC4R P32245 1/20 0.42
ALDH1A1 P00352 4/20 0.36
TSHR P16473 2/20 0.36
CYP3A4 P08684 2/20 0.36
CYP2C19 P33261 1/20 0.36
HSD11B1 P28845 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
LMNA P02545 1/20 0.34
HTT P42858 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
KCNA5 P22460 1/20 0.34

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
SCHEMBL9524001 1.00 CYP2D6 (0.47) CYP2D6OPRM1OPRD1OPRK1OPRL1
SCHEMBL4665249 0.75 CYP2D6 (0.50) CYP2D6OPRM1OPRD1OPRK1OPRL1
SCHEMBL22280809 0.75
SCHEMBL3785866 0.73 CYP2D6 (0.61) CYP2D6OPRM1OPRD1OPRK1OPRL1
SCHEMBL2337932 0.73 CYP2D6 (0.65) CYP2D6OPRM1OPRD1OPRK1OPRL1
Hydrochloric Acid SCHEMBL2330314 0.71 CYP2D6 (0.63) CYP2D6OPRM1OPRD1OPRK1OPRL1
SCHEMBL2485451 0.70 CYP2D6 (0.73) CYP2D6OPRM1OPRD1OPRK1OPRL1
SCHEMBL769095 0.70 HSD11B1 (0.43) CYP2D6OPRM1OPRD1OPRK1OPRL1
SCHEMBL4631202 0.70 CYP2D6 (0.73) CYP2D6OPRM1OPRD1OPRK1OPRL1
SCHEMBL23268588 0.69 CYP2D6 (0.55) CYP2D6OPRM1OPRD1OPRK1OPRL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0529688-B1 Azaspiro(n,m)alkanes and diazaspiro(n,m)-alkanes DAIICHI SEIYAKU CO (JP) 1997-11-12 EP disclosed
US-5508428-A Spiro compound DAIICHI PHAMACEUTICAL CO., LTD. (JP) 1996-04-16 US disclosed
US-5286723-A Spiro compound DAIICHI SEIYAKU CO., LTD. 1994-02-15 US disclosed
EP-0357047-B1 Spiro compounds DAIICHI SEIYAKU CO (JP) 1993-11-03 EP disclosed
EP-0529688-A2 Azaspiro n,m alkanes and diazaspiro n,m -alkanes DAIICHI PHARMACEUTICAL CO., LTD. (JP) 1993-03-03 EP disclosed
EP-0357047-A1 Spiro compounds DAIICHI PHARMACEUTICAL CO., LTD. (JP) 1990-03-07 EP disclosed