SCHEMBL6151815

SCHEMBL6151815

CC(C(=O)c1ccc(O)cc1)N1CCC(O)(c2ccccc2)CC1

nearest known ligand 0.68

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GRIN2B Q13224 10/20 0.68
GRIN2D O15399 1/20 0.60
GRIN3B O60391 1/20 0.60
CYP2D6 P10635 1/20 0.60
GRIN1 Q05586 1/20 0.60
KCNH2 Q12809 1/20 0.60
GRIN2A Q12879 1/20 0.60
GRIN2C Q14957 1/20 0.60
GRIN3A Q8TCU5 1/20 0.60
OPRM1 P35372 7/20 0.58
OPRK1 P41145 7/20 0.58
OPRL1 P41146 7/20 0.58
OPRD1 P41143 6/20 0.58

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
SCHEMBL6152306 0.86 OPRL1 (0.54) GRIN2BGRIN2DGRIN3BCYP2D6GRIN1
SCHEMBL6902857 0.86 OPRL1 (0.54) GRIN2BOPRM1OPRK1OPRL1OPRD1
SCHEMBL6690779 0.84 GRIN2B (0.50) GRIN2BOPRM1OPRK1OPRL1OPRD1
SCHEMBL6151725 0.84 GRIN2B (0.50) GRIN2BOPRM1OPRK1OPRL1OPRD1
SCHEMBL6152148 0.84 GRIN2B (0.50) GRIN2BOPRM1OPRK1OPRL1OPRD1
SCHEMBL8857324 0.83 OPRL1 (0.51) GRIN2BOPRM1OPRK1OPRL1OPRD1
SCHEMBL7330603 0.82 OPRL1 (0.50) GRIN2BGRIN2DGRIN3BCYP2D6GRIN1
SCHEMBL8857496 0.81 GRIN2B (0.70) GRIN2BGRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL16608330 0.81 GRIN2B (1.00) GRIN2B
SCHEMBL16601285 0.81 GRIN2B (1.00) GRIN2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6743921-B2 HYDROGENATION OF A CORRESPONDING NONRACEMIC 1-(4-BENZOXY PHENYL)-2-(4-HYDROXY-4-PHENYL-PIPERIDIN-1-YL)-1-PROPANONE USING A CATALYST SYSTEM COMPRISING RUTHENIUM, A NONRACEMIC DIPHOSPHINE LIGAND, A BIDENTATE AMINE LIGAND SELECTED FROM DSM CATALYTICA PHARMACEUTICALS, INC. 2004-06-01 US claimed
US-20030144521-A1 Process for the preparation of nonracemic syn-1-(4-hydroxy-phenyl)-2-(4-hydroxy-4-phenyl -piperidin-1-yl)-1-propanol compounds DSM CATALYTICA PHARMACEUTICALS, INC. 2003-07-31 US claimed
WO-2003062180-A1 PROCESS FOR THE PREPARATION OF NONRACEMIC SYN-1-(4-HYDROXY-PHENYL)-2-(4-HYDROXY-4-PHENYL-PIPERIDIN-1-YL)-1-PROPANOL COMPOUNDS DSM N.V. (NL) 2003-07-31 WO claimed
EP-1497245-A1 PROCESS FOR THE PREPARATION OF NONRACEMIC SYN-1-(4-HYDROXY-PHENYL)-2-(4-HYDROXY-4-PHENYL.PIPERIDIN-1Yl)-1-PROPANOL COMPOUNDS DSM Pharmaceuticals, Inc. (US) 2005-01-19 EP disclosed
US-6743921-B2 HYDROGENATION OF A CORRESPONDING NONRACEMIC 1-(4-BENZOXY PHENYL)-2-(4-HYDROXY-4-PHENYL-PIPERIDIN-1-YL)-1-PROPANONE USING A CATALYST SYSTEM COMPRISING RUTHENIUM, A NONRACEMIC DIPHOSPHINE LIGAND, A BIDENTATE AMINE LIGAND SELECTED FROM DSM CATALYTICA PHARMACEUTICALS, INC. 2004-06-01 US disclosed
US-20030144521-A1 Process for the preparation of nonracemic syn-1-(4-hydroxy-phenyl)-2-(4-hydroxy-4-phenyl -piperidin-1-yl)-1-propanol compounds DSM CATALYTICA PHARMACEUTICALS, INC. 2003-07-31 US disclosed
WO-2003062180-A1 PROCESS FOR THE PREPARATION OF NONRACEMIC SYN-1-(4-HYDROXY-PHENYL)-2-(4-HYDROXY-4-PHENYL-PIPERIDIN-1-YL)-1-PROPANOL COMPOUNDS DSM N.V. (NL) 2003-07-31 WO disclosed
WO-2003062181-A1 PROCESS FOR THE PREPARATION OF NONRACEMIC SYN-1-(4-HYDROXY-PHENYL)-2-(4-HYDROXY-4-PHENYL.PIPERIDIN-1Yl)-1-PROPANOL COMPOUNDS DSM PHARMACEUTICALS, INC. (US) 2003-07-31 WO disclosed
US-5696126-A Prodrug esters of phenolic 2-piperidino-1-alkanols PFIZER INC. (US) 1997-12-09 US disclosed
US-5654302-A Prodrug esters of phenolic 2-piperidino-1-alkanols PFIZER INC. (US) 1997-08-05 US disclosed
US-5594007-A Method for treating spinal cord trauma with phenolic 2-piperidino-1-alkanols PFIZER INC. (US) 1997-01-14 US disclosed
US-5455250-A Prodrug esters of phenolic 2-piperidino-1-alkanols PFIZER INC. (US) 1995-10-03 US disclosed
EP-0584192-A1 PRODRUG ESTERS OF PHENOLIC 2-PIPERIDINO-1-ALKANOLS PFIZER INC. (US) 1994-03-02 EP disclosed
WO-1992018502-A1 PRODRUG ESTERS OF PHENOLIC 2-PIPERIDINO-1-ALKANOLS PFIZER INC. (US) 1992-10-29 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20030144521-A1 Process for the preparation of nonracemic syn-1-(4-hydroxy-phenyl)-2-(4-hydroxy-4-phenyl -piperidin-1-yl)-1-propanol compounds SYNJ1, HRH4, HRH3 GRIN2B 2908/4885GRIN2D 2117/4885GRIN3B 2164/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.