SCHEMBL4545446

SCHEMBL4545446

COCCOCOc1ccc2c3c1O[C@H]1[C@@H](O)C=CC4[C@@H](C2)N(C)CC[C@@]341

nearest known ligand 0.75

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 14/20 0.75
OPRK1 P41145 10/20 0.75
MRGPRX2 Q96LB1 4/20 0.75
OPRD1 P41143 4/20 0.75
ADRB1 P08588 1/20 0.75
PDE4D Q08499 1/20 0.75
PDE3A Q14432 1/20 0.75
SLC22A1 O15245 1/20 0.65
ADRA2A P08913 1/20 0.65
ARRB1 P49407 1/20 0.65

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
SCHEMBL6865490 0.93 OPRD1 (0.81) OPRM1OPRK1MRGPRX2OPRD1ADRB1
SCHEMBL6865494 0.93 OPRD1 (0.81) OPRM1OPRK1MRGPRX2OPRD1ADRB1
SCHEMBL4545443 0.90 OPRM1 (0.68) OPRM1OPRK1MRGPRX2OPRD1ADRB1
SCHEMBL11503572 0.88 OPRD1 (0.78) OPRM1OPRK1MRGPRX2OPRD1ADRB1
SCHEMBL10537816 0.88 OPRD1 (0.78) OPRM1OPRK1MRGPRX2OPRD1ADRB1
SCHEMBL25330324 0.88 OPRD1 (0.78) OPRM1OPRK1MRGPRX2OPRD1ADRB1
Ethylmorphine SCHEMBL16922138 0.87 OPRD1 (0.80) OPRM1OPRK1MRGPRX2OPRD1ADRB1
Ethylmorphine SCHEMBL14611951 0.87 OPRD1 (0.80) OPRM1OPRK1MRGPRX2OPRD1ADRB1
Ethylmorphine SCHEMBL14516212 0.87 OPRD1 (0.80) OPRM1OPRK1MRGPRX2OPRD1ADRB1
Ethylmorphine SCHEMBL15757784 0.87 OPRD1 (0.80) OPRM1OPRK1MRGPRX2OPRD1ADRB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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-20190046523-A1 OLIGOMER-OPIOID AGONIST CONJUGATES NEKTAR THERAPEUTICS 2019-02-14 US disclosed
US-9925182-B2 Compositions, dosage forms, and co-administration of an opioid agonist compound and an analgesic compound NEKTAR THERAPEUTICS (US) 2018-03-27 US disclosed
US-9925182-B2 Compositions, dosage forms, and co-administration of an opioid agonist compound and an analgesic compound NEKTAR THERAPEUTICS (US) 2018-03-27 US disclosed
US-9827239-B2 Oligomer-opioid agonist conjugates NEKTAR THERAPEUTICS (US) 2017-11-28 US disclosed
US-9827239-B2 Oligomer-opioid agonist conjugates NEKTAR THERAPEUTICS (US) 2017-11-28 US disclosed
US-20170112826-A1 OLIGOMER-OPIOID AGONIST CONJUGATES NEKTAR THERAPEUTICS 2017-04-27 US disclosed
US-20170112826-A1 OLIGOMER-OPIOID AGONIST CONJUGATES NEKTAR THERAPEUTICS 2017-04-27 US disclosed
US-20170079975-A1 Compositions, Dosage Forms, and Co-Administration of an Opioid Agonist Compound and an Analgesic Compound NEKTAR THERAPEUTICS 2017-03-23 US disclosed
US-20120264775-A1 Oligomer-Opioid Agonist Conjugates NEKTAR THERAPEUTICS (US) 2012-10-18 US disclosed
US-20120264775-A1 Oligomer-Opioid Agonist Conjugates NEKTAR THERAPEUTICS (US) 2012-10-18 US disclosed
US-20120184581-A1 Oligomer-Opioid Agonist Conjugates NEKTAR THERAPEUTICS (US) 2012-07-19 US disclosed
US-20120184581-A1 Oligomer-Opioid Agonist Conjugates NEKTAR THERAPEUTICS (US) 2012-07-19 US disclosed
US-8173666-B2 Oligomer-opioid agonist conjugates NEKTAR THERAPEUTICS (US) 2012-05-08 US disclosed
US-8173666-B2 Oligomer-opioid agonist conjugates NEKTAR THERAPEUTICS (US) 2012-05-08 US disclosed
US-20110237614-A1 Pegylated Opioids with Low Potential for Abuse NEKTAR THERAPEUTICS (US) 2011-09-29 US disclosed
US-20110237614-A1 Pegylated Opioids with Low Potential for Abuse NEKTAR THERAPEUTICS (US) 2011-09-29 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

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

For each of this compound's patents that has machine-readable text (9 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-20170112826-A1 OLIGOMER-OPIOID AGONIST CONJUGATES OPRM1, OPRL1, OPRK1 OPRM1 1/4885OPRK1 3/4885MRGPRX2 311/4885
US-10307416-B2 Oligomer-opioid agonist conjugates OPRM1, OPRL1, OPRK1 OPRM1 1/4885OPRK1 3/4885MRGPRX2 311/4885
US-20170079975-A1 Compositions, Dosage Forms, and Co-Administration of an Opioid Agonist Compound and an Analgesic Compound OPRL1, OPRM1, OPRK1 OPRM1 2/4885OPRK1 3/4885MRGPRX2 69/4885
US-20190046523-A1 OLIGOMER-OPIOID AGONIST CONJUGATES OPRM1, OPRL1, OPRK1 OPRM1 1/4885OPRK1 3/4885MRGPRX2 311/4885
US-20110237614-A1 Pegylated Opioids with Low Potential for Abuse OPRL1, OPRM1, OPRK1 OPRM1 2/4885OPRK1 3/4885MRGPRX2 509/4885
US-20190247388-A1 OLIGOMER-OPIOID AGONIST CONJUGATES OPRM1, OPRL1, OPRK1 OPRM1 1/4885OPRK1 3/4885MRGPRX2 311/4885
US-20120184581-A1 Oligomer-Opioid Agonist Conjugates OPRM1, OPRL1, OPRK1 OPRM1 1/4885OPRK1 3/4885MRGPRX2 311/4885
US-20100048602-A1 Oligomer-Opioid Agonist Conjugates OPRM1, OPRL1, OPRK1 OPRM1 1/4885OPRK1 3/4885MRGPRX2 311/4885
US-20120264775-A1 Oligomer-Opioid Agonist Conjugates OPRM1, OPRL1, OPRK1 OPRM1 1/4885OPRK1 3/4885MRGPRX2 311/4885

“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.