SCHEMBL990094

SCHEMBL990094

CCC(=O)N(c1ccc(O)cc1)C1CCN(CCc2ccccc2)CC1

nearest known ligand 0.87

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 10/20 0.87
OPRD1 P41143 5/20 0.87
OPRK1 P41145 5/20 0.87
SIGMAR1 Q99720 2/20 0.87
SLC22A1 O15245 1/20 0.87
NR1I2 O75469 1/20 0.87
ABCB1 P08183 1/20 0.87
CHRM1 P11229 1/20 0.87
DRD2 P14416 1/20 0.87
ADRA2B P18089 1/20 0.87
ADRA2C P18825 1/20 0.87
CHRM3 P20309 1/20 0.87
MAOA P21397 1/20 0.87
DRD4 P21917 1/20 0.87
MAOB P27338 1/20 0.87
ADRA1A P35348 1/20 0.87
HRH1 P35367 1/20 0.87
ADRA1B P35368 1/20 0.87
DRD3 P35462 1/20 0.87
CHRNA4 P43681 1/20 0.87

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
SCHEMBL23651660 0.95 OPRM1 (0.87) OPRM1OPRD1OPRK1SIGMAR1SLC22A1
Fentanyl SCHEMBL916599 0.93 OPRM1 (1.00) OPRM1OPRD1OPRK1SIGMAR1SLC22A1
Fentanyl SCHEMBL8804 0.93 OPRM1 (1.00) OPRM1OPRD1OPRK1SIGMAR1SLC22A1
Fentanyl SCHEMBL28383546 0.92 OPRM1 (0.98) OPRM1OPRD1OPRK1SIGMAR1SLC22A1
Fentanyl SCHEMBL22637301 0.92 OPRM1 (0.98) OPRM1OPRD1OPRK1SIGMAR1SLC22A1
Fentanyl SCHEMBL4324385 0.92 OPRM1 (0.98) OPRM1OPRD1OPRK1SIGMAR1SLC22A1
Fentanyl SCHEMBL4971300 0.92 OPRM1 (0.98) OPRM1OPRD1OPRK1SIGMAR1SLC22A1
Fentanyl SCHEMBL18249370 0.92 OPRM1 (0.98) OPRM1OPRD1OPRK1SIGMAR1SLC22A1
Fentanyl SCHEMBL4321837 0.92 OPRM1 (0.98) OPRM1OPRD1OPRK1SIGMAR1SLC22A1
Fentanyl SCHEMBL4353786 0.92 OPRM1 (0.98) OPRM1OPRD1OPRK1SIGMAR1SLC22A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200078353-A1 OLIGOMER-OPIOID AGONIST CONJUGATES INHERIS BIOPHARMA INC (US) 2020-03-12 US disclosed
CN-105503889-B Oligomer-opioid agonist conjugates 尼克塔治疗公司 2019-12-24 CN disclosed
US-20190247388-A1 OLIGOMER-OPIOID AGONIST CONJUGATES NEKTAR THERAPEUTICS 2019-08-15 US disclosed
US-20190247388-A1 OLIGOMER-OPIOID AGONIST CONJUGATES NEKTAR THERAPEUTICS 2019-08-15 US disclosed
US-10307416-B2 Oligomer-opioid agonist conjugates NEKTAR THERAPEUTICS (US) 2019-06-04 US disclosed
US-10307416-B2 Oligomer-opioid agonist conjugates NEKTAR THERAPEUTICS (US) 2019-06-04 US disclosed
US-20190046523-A1 OLIGOMER-OPIOID AGONIST CONJUGATES NEKTAR THERAPEUTICS 2019-02-14 US disclosed
US-20190046523-A1 OLIGOMER-OPIOID AGONIST CONJUGATES NEKTAR THERAPEUTICS 2019-02-14 US disclosed
US-10143690-B2 Oligomer-opioid agonist conjugates NEKTAR THERAPEUTICS (US) 2018-12-04 US disclosed
US-20180296550-A1 Compositions, Dosage Forms, and Co-Administration of an Opioid Agonist Compound and an Analgesic Compound NEKTAR THERAPEUTICS 2018-10-18 US disclosed
WO-2011011543-A1 OLIGOMER-OPIOID AGONIST CONJUGATES NEKTAR THERAPEUTICS (US) 2011-01-27 WO disclosed
US-20100048602-A1 Oligomer-Opioid Agonist Conjugates NEKTAR THERAPEUTICS (US) 2010-02-25 US disclosed
US-20100048602-A1 Oligomer-Opioid Agonist Conjugates NEKTAR THERAPEUTICS (US) 2010-02-25 US disclosed
US-20100048602-A1 Oligomer-Opioid Agonist Conjugates NEKTAR THERAPEUTICS (US) 2010-02-25 US disclosed
CN-100402084-C Method for detection or quantitative determination of metabolite of fentanyl or metabolite of fentanyl analogues and kit LANDAUKES LAB CO LTD (GB) 2008-07-16 CN disclosed
EP-1312923-B1 Method and kit for detecting, or determining the quantity of, metabolites of fentanyl and metabolites of fentanyl analogs RANDOX LAB LTD (GB) 2007-03-28 EP disclosed
US-7109310-B2 Method and kit for detecting, or determining the quantity of, metabolites of fentanyl and metabolites of fentanyl analogs RANDOX LABORATORIES, LTD. (IE) 2006-09-19 US disclosed
US-20030170728-A1 Method and kit for detecting, or determining the quantity of, metabolites of fentanyl and metabolites of fentanyl analogs RANDOX LABORATORIES LIMITED 2003-09-11 US disclosed
CN-1428607-A Method for detection or quantitative determination of metabolite of fentanyl or metabolite of fentanyl analogues and kit LANDAUKES LAB CO LTD (GB) 2003-07-09 CN disclosed
EP-1312923-A2 Method and kit for detecting, or determining the quantity of, metabolites of fentanyl and metabolites of fentanyl analogs Randox Laboratories Ltd. (GB) 2003-05-21 EP 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 (8 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-10143690-B2 Oligomer-opioid agonist conjugates OPRM1, OPRL1, OPRK1 OPRM1 1/4885OPRD1 5/4885OPRK1 3/4885
US-20200078353-A1 OLIGOMER-OPIOID AGONIST CONJUGATES OPRM1, OPRL1, OPRK1 OPRM1 1/4885OPRD1 5/4885OPRK1 3/4885
US-10307416-B2 Oligomer-opioid agonist conjugates OPRM1, OPRL1, OPRK1 OPRM1 1/4885OPRD1 5/4885OPRK1 3/4885
US-20190046523-A1 OLIGOMER-OPIOID AGONIST CONJUGATES OPRM1, OPRL1, OPRK1 OPRM1 1/4885OPRD1 5/4885OPRK1 3/4885
US-20030170728-A1 Method and kit for detecting, or determining the quantity of, metabolites of fentanyl and metabolites of fentanyl analogs OPRK1, KIT, OPRM1 OPRM1 3/4885OPRD1 14/4885OPRK1 1/4885
US-20190247388-A1 OLIGOMER-OPIOID AGONIST CONJUGATES OPRM1, OPRL1, OPRK1 OPRM1 1/4885OPRD1 5/4885OPRK1 3/4885
US-20180296550-A1 Compositions, Dosage Forms, and Co-Administration of an Opioid Agonist Compound and an Analgesic Compound OPRL1, OPRM1, OPRK1 OPRM1 2/4885OPRD1 4/4885OPRK1 3/4885
US-20100048602-A1 Oligomer-Opioid Agonist Conjugates OPRM1, OPRL1, OPRK1 OPRM1 1/4885OPRD1 5/4885OPRK1 3/4885

“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.