SCHEMBL8978975

SCHEMBL8978975

CCOC(=O)COc1ccc2c3c1O[C@H]1[C@@H](O)C=C[C@H]4[C@@H](C2)N(C)CC[C@@]341

nearest known ligand 0.70

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ OPRM1 P35372 7/20 0.70
▸ OPRD1 P41143 7/20 0.70
▸ OPRK1 P41145 5/20 0.70
▸ MRGPRX2 Q96LB1 4/20 0.70
▸ ADRB1 P08588 1/20 0.70
▸ PDE4D Q08499 1/20 0.70
▸ PDE3A Q14432 1/20 0.70
▸ SLC22A1 O15245 1/20 0.63
▸ ADRA2A P08913 1/20 0.63
▸ ARRB1 P49407 1/20 0.63

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
SCHEMBL2351367 0.92 OPRD1 (0.73) OPRM1OPRD1OPRK1MRGPRX2ADRB1
SCHEMBL14516209 0.90 OPRM1 (0.75) OPRM1OPRD1OPRK1MRGPRX2ADRB1
SCHEMBL1685975 0.90 OPRM1 (0.75) OPRM1OPRD1OPRK1MRGPRX2ADRB1
Ethylmorphine SCHEMBL24971 0.90 OPRD1 (0.80) OPRM1OPRD1OPRK1MRGPRX2ADRB1
Ethylmorphine SCHEMBL14516212 0.90 OPRD1 (0.80) OPRM1OPRD1OPRK1MRGPRX2ADRB1
Ethylmorphine SCHEMBL29392212 0.90 OPRD1 (0.80) OPRM1OPRD1OPRK1MRGPRX2ADRB1
Ethylmorphine SCHEMBL15757784 0.90 OPRD1 (0.80) OPRM1OPRD1OPRK1MRGPRX2ADRB1
Ethylmorphine SCHEMBL16922138 0.90 OPRD1 (0.80) OPRM1OPRD1OPRK1MRGPRX2ADRB1
Ethylmorphine SCHEMBL15653227 0.90 OPRD1 (0.80) OPRM1OPRD1OPRK1MRGPRX2ADRB1
Ethylmorphine SCHEMBL14611951 0.90 OPRD1 (0.80) OPRM1OPRD1OPRK1MRGPRX2ADRB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0467078-B1 An analyte-subtitute reagent for use in specific binding assay methods, devices and kits ABBOTT LAB (US) 1996-05-08 — — EP disclosed
US-5501985-A DETERMINATION OF LOW MOLECULAR WEIGHT, STEROIDS, HORMONES, ANTIBIOTICS, DRUGS ABBOTT LABORATORIES (US) 1996-03-26 — — US disclosed
US-5340748-A Analyte-substitute reagent for use in specific binding assay methods, devices and kits ABBOTT LABORATORIES (US) 1994-08-23 — — US disclosed
US-5260441-A Fluorescence polarization process for detecting unauthorized consumption of morphine ABBOTT LABORATORIES (US) 1993-11-09 — — US disclosed
US-5258512-A Immunoassay for opiate alkaloids and their metabolites; tracers, immunogens and antibodies ABBOTT LABORATORIES (US) 1993-11-02 — — US disclosed
EP-0467078-A2 An analyte-subtitute reagent for use in specific binding assay methods, devices and kits ABBOTT LABORATORIES (US) 1992-01-22 — — EP disclosed
US-4939264-A Immunoassay for opiate alkaloids and their metabolites; tracers, immunogens and antibodies ABBOTT LABORATORIES (US) 1990-07-03 — — US disclosed
EP-0254120-A2 Immunoassay for opiate alkaloids and their metabolites; tracers, immunogens and antibodies ABBOTT LABORATORIES (US) 1988-01-27 — — EP disclosed
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