SCHEMBL8567936

SCHEMBL8567936

COc1ccc(C(O)C(C)N2CCC(O)(Cc3ccccc3)CC2)cc1

nearest known ligand 0.78

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 2/20 0.64
OPRK1 P41145 3/20 0.55
OPRM1 P35372 2/20 0.55
OPRD1 P41143 2/20 0.55
OPRL1 P41146 2/20 0.55
GRIN2B Q13224 4/20 0.52
GRIN1 Q05586 3/20 0.52
GRIN2D O15399 2/20 0.52
KCNH2 Q12809 2/20 0.52
GRIN2A Q12879 2/20 0.52
GRIN2C Q14957 2/20 0.52
GRIN3B O60391 1/20 0.52
CYP2D6 P10635 1/20 0.52
GRIN3A Q8TCU5 1/20 0.52
ADRA2A P08913 3/20 0.47
HTR2A P28223 3/20 0.47
ADRA1A P35348 3/20 0.47
SIGMAR1 Q99720 3/20 0.47
HTR1A P08908 2/20 0.47
HTR2B P41595 2/20 0.47

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
SCHEMBL7329204 1.00 SLC6A4 (0.64) SLC6A4OPRK1OPRM1OPRD1OPRL1
SCHEMBL7332146 0.90 SLC6A4 (0.56) SLC6A4OPRK1OPRM1OPRD1OPRL1
SCHEMBL7332152 0.90 SLC6A4 (0.56) SLC6A4OPRK1OPRM1OPRD1OPRL1
SCHEMBL7330989 0.88 GRIN2B (0.67) SLC6A4OPRK1OPRM1OPRD1OPRL1
SCHEMBL7330165 0.88 GRIN2B (0.67) SLC6A4OPRK1OPRM1OPRD1OPRL1
SCHEMBL7330161 0.88 GRIN2B (0.67) SLC6A4OPRK1OPRM1OPRD1OPRL1
SCHEMBL7328022 0.88 SLC6A4 (0.55) SLC6A4OPRK1OPRM1OPRD1OPRL1
SCHEMBL7328026 0.88 SLC6A4 (0.55) SLC6A4OPRK1OPRM1OPRD1OPRL1
SCHEMBL7328785 0.87 SLC6A4 (0.57) SLC6A4OPRK1OPRM1OPRD1OPRL1
SCHEMBL7328780 0.87 SLC6A4 (0.57) SLC6A4OPRK1OPRM1OPRD1OPRL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5710168-A 2-piperidino-1-alkanol derivatives as neuroprotective agents PFIZER INC. (US) 1998-01-20 US disclosed
US-5527912-A USEFUL INTREATMENT OF CENTRAL NERVOUS SYSTEM DISORDERS PFIZER INC. (US) 1996-06-18 US disclosed
US-5391742-A Intermediates for 2-piperidino-1-alkanols PFIZER INC. (US) 1995-02-21 US disclosed
US-5338754-A 2-pyrrolidino-1-alkanol derivatives as antiischemic agents PFIZER INC (US) 1994-08-16 US disclosed
US-5185343-A NORTROPYL-1-ALKANOL DERIVATIVES AS ANTIISCHEMIC AGENTS PFIZER INC. (US) 1993-02-09 US disclosed
WO-1990014087-A1 2-PIPERIDINO-1-ALKANOL DERIVATIVES AS ANTIISCHEMIC AGENTS PFIZER INC. (US) 1990-11-29 WO disclosed
WO-1990014088-A1 2-PIPERIDINO-1-ALKANOL DERIVATIVES AS ANTIISCHEMIC AGENTS PFIZER INC. (US) 1990-11-29 WO disclosed