SCHEMBL1032567

SCHEMBL1032567

C[C@H]1OC(Oc2ccc3c4c2O[C@H]2[C@@H](O)C=C[C@H]5[C@@H](C3)N(C)CC[C@@]452)[C@H](O)[C@@H](O)[C@@H]1O

nearest known ligand 0.71

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
OPRD1 P41143 8/20 0.71
OPRM1 P35372 6/20 0.71
OPRK1 P41145 4/20 0.71
MRGPRX2 Q96LB1 4/20 0.71
ADRB1 P08588 1/20 0.71
PDE4D Q08499 1/20 0.71
PDE3A Q14432 1/20 0.71
SLC22A1 O15245 1/20 0.64
ADRA2A P08913 1/20 0.64
ARRB1 P49407 1/20 0.64

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
SCHEMBL8370691 0.91 MRGPRX2 (0.71) OPRD1OPRM1OPRK1MRGPRX2ADRB1
Morphine 3-Glucuronide SCHEMBL3843209 0.89 MRGPRX2 (0.74) OPRD1OPRM1OPRK1MRGPRX2ADRB1
Morphine 3-Glucuronide SCHEMBL614298 0.89 MRGPRX2 (0.74) OPRD1OPRM1OPRK1MRGPRX2ADRB1
Codeine SCHEMBL8218174 0.84 OPRD1 (1.00) OPRD1OPRM1OPRK1MRGPRX2ADRB1
Codeine SCHEMBL14371354 0.84 OPRD1 (1.00) OPRD1OPRM1OPRK1MRGPRX2ADRB1
Codeine SCHEMBL1560699 0.84 OPRD1 (1.00) OPRD1OPRM1OPRK1MRGPRX2ADRB1
Codeine SCHEMBL13696342 0.84 OPRD1 (1.00) OPRD1OPRM1OPRK1MRGPRX2ADRB1
Codeine SCHEMBL10329428 0.84 OPRD1 (1.00) OPRD1OPRM1OPRK1MRGPRX2ADRB1
Codeine SCHEMBL21077535 0.84 OPRD1 (1.00) OPRD1OPRM1OPRK1MRGPRX2ADRB1
Codeine SCHEMBL3257 0.84 OPRD1 (1.00) OPRD1OPRM1OPRK1MRGPRX2ADRB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3740115-B1 A BIOASSAY FOR THE NON-INVASIVE DETECTION OF DRUG USE AND PHYSIOLOGIC CONDITIONS CHILDRENS NAT MEDICAL CT (US) 2025-08-27 EP claimed
EP-1912658-B1 THERAPEUTIC PROTOCOLS USING HYALURONAN ALCHEMIA ONCOLOGY PTY LTD (AU) 2017-01-25 EP claimed
EP-2301526-B1 Morphine controlled release system EGALET LTD (GB) 2016-03-23 EP claimed
EP-1610767-B1 MORPHINE CONTROLLED RELEASE SYSTEM EGALET AS (DK) 2011-01-19 EP claimed
EP-0496839-B2 VACCINE AGAINST DRUGS OF ABUSE CHILKA LTD (VG) 2004-03-03 EP disclosed
EP-1183023-A1 USE OF VERAPAMIL AND VERAPAMIL DERIVATIVES FOR PRODUCING MEDICAMENTS WITH AN INHIBITING EFFECT ON BETA-GLUCURONIDASE IN HUMAN TISSUE PAZ ARZNEIMITTEL- ENTWICKLUNGSGESELLSCHAFT MBH (DE) 2002-03-06 EP disclosed
WO-2000074670-A1 USE OF VERAPAMIL AND VERAPAMIL DERIVATIVES FOR PRODUCING MEDICAMENTS WITH AN INHIBITING EFFECT ON β-GLUCURONIDASE IN HUMAN TISSUE PAZ ARZNEIMITTEL-ENTWICKLUNGS GESELLSCHAFT MBH (DE) 2000-12-14 WO disclosed
EP-0496839-B1 VACCINE AGAINST DRUGS OF ABUSE BIO DEV LTD (IR) 1996-05-15 EP disclosed
EP-0496839-A1 VACCINE AND IMMUNOSERUM AGAINST DRUGS OF ABUSE. CERNY ERICH H (CH) 1992-08-05 EP disclosed
WO-1992003163-A1 VACCINE AND IMMUNOSERUM AGAINST DRUGS OF ABUSE CERNY ERICH H (CH) 1992-03-05 WO disclosed