SCHEMBL4240600

SCHEMBL4240600

C[N+](C)([O-])CCC1(c2cccc(O)c2)CCCCC1

nearest known ligand 0.51

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 6/20 0.49
ACHE P22303 3/20 0.49
OPRM1 P35372 2/20 0.49
SLC22A1 O15245 1/20 0.49
CHRM2 P08172 1/20 0.49
CYP2D6 P10635 1/20 0.49
SLC6A3 Q01959 4/20 0.41
SLC6A2 P23975 3/20 0.40
MEN1 O00255 1/20 0.40
OPRD1 P41143 1/20 0.40
OPRK1 P41145 1/20 0.40
KMT2A Q03164 1/20 0.40

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
SCHEMBL13636459 0.81 SLC6A4 (0.51) SLC6A4ACHEOPRM1SLC22A1CHRM2
SCHEMBL557756 0.77 SLC6A4 (0.51) SLC6A4ACHEOPRM1SLC22A1CHRM2
SCHEMBL11632321 0.73 SLC6A4 (0.50) SLC6A4ACHEOPRM1SLC22A1CHRM2
SCHEMBL2499568 0.71 HSD11B1 (0.56) SLC6A4ACHEOPRM1SLC22A1CHRM2
SCHEMBL2505252 0.69 SLC6A4 (0.49) SLC6A4ACHEOPRM1SLC22A1CHRM2
SCHEMBL5808986 0.69 OPRD1 (0.67) SLC6A4ACHEOPRM1SLC22A1CHRM2
SCHEMBL30475863 0.68 ESR1 (0.57) SLC6A4ACHEOPRM1SLC22A1CHRM2
SCHEMBL6656340 0.67 ACHE (0.46) SLC6A4ACHEOPRM1SLC22A1CHRM2
SCHEMBL542062 0.67 ACHE (0.77) SLC6A4ACHEOPRM1SLC22A1CHRM2
SCHEMBL7674020 0.67 SLC6A4 (0.59) SLC6A4ACHEOPRM1SLC22A1CHRM2

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 27 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11224576-B2 Process for the production of an abuse-proofed dosage form Grünenthal GmbH (DE) 2022-01-18 US disclosed
US-10729658-B2 Process for the production of an abuse-proofed dosage form Grünenthal GmbH (DE) 2020-08-04 US disclosed
US-20160367487-A1 PROCESS FOR THE PRODUCTION OF AN ABUSE-PROOFED DOSAGE FORM Grünenthal GmbH (DE) 2016-12-22 US disclosed
US-20160367486-A1 PROCESS FOR THE PRODUCTION OF AN ABUSE-PROOFED DOSAGE FORM Grünenthal GmbH (DE) 2016-12-22 US disclosed
US-20160367485-A1 PROCESS FOR THE PRODUCTION OF AN ABUSE-PROOFED DOSAGE FORM Grünenthal GmbH (DE) 2016-12-22 US disclosed
US-20150283086-A1 PROCESS FOR THE PRODUCTION OF AN ABUSE-PROOFED DOSAGE FORM Grünenthal GmbH (DE) 2015-10-08 US disclosed
US-20150164811-A1 PROCESS FOR THE PRODUCTION OF AN ABUSE-PROOFED DOSAGE FORM Grünenthal GmbH (DE) 2015-06-18 US disclosed
US-20150091201-A1 PROCESS FOR THE PRODUCTION OF AN ABUSE-PROOFED DOSAGE FORM Grünenthal GmbH (DE) 2015-04-02 US disclosed
US-8722086-B2 Dosage form with impeded abuse GRUENENTHAL GMBH (DE) 2014-05-13 US disclosed
EP-1740156-B8 METHOD FOR THE PRODUCTION OF AN ABUSE-PROOF, SOLID FORM OF ADMINISTRATION GRUENENTHAL GMBH (DE) 2012-07-11 EP disclosed
EP-1699440-A1 METHOD FOR THE PRODUCTION OF AN ADMINISTRATION FORM WHICH IS SECURED AGAINST MISUSE Grünenthal GmbH (DE) 2006-09-13 EP disclosed
US-20060188447-A1 Process for the production of an abuse-proofed dosage form ENDO PHARMACEUTICALS INC. 2006-08-24 US disclosed
EP-1658054-A1 DOSAGE FORM THAT IS SAFEGUARDED FROM ABUSE Grünenthal GmbH (DE) 2006-05-24 EP disclosed
EP-1658055-A1 FORM OF ADMINISTRATION SECURED AGAINST MISUSE Grünenthal GmbH (DE) 2006-05-24 EP disclosed
WO-2006002883-A1 METHOD FOR PRODUCING A SOLID DOSAGE FORM, WHICH IS SAFEGUARDED AGAINST ABUSE, WHILE USING A PLANETARY GEAR EXTRUDER Grünenthal GmbH (DE) 2006-01-12 WO disclosed
WO-2005102294-A2 TRANSDERMAL SYSTEM SECURED AGAINST MISUSE Grünenthal GmbH (DE) 2005-11-03 WO disclosed
WO-2005102286-A1 METHOD FOR THE PRODUCTION OF AN ABUSE-PROOF, SOLID FORM OF ADMINISTRATION Grünenthal GmbH (DE) 2005-11-03 WO disclosed
WO-2005063214-A1 METHOD FOR THE PRODUCTION OF AN ADMINISTRATION FORM WHICH IS SECURED AGAINST MISUSE Grünenthal GmbH (DE) 2005-07-14 WO disclosed
WO-2005016314-A1 FORM OF ADMINISTRATION SECURED AGAINST MISUSE Grünenthal GmbH (DE) 2005-02-24 WO disclosed
WO-2005016313-A1 DOSAGE FORM THAT IS SAFEGUARDED FROM ABUSE Grünenthal GmbH (DE) 2005-02-24 WO disclosed