SCHEMBL2240259

SCHEMBL2240259

O=C1NCN(c2ccccc2)C12CCN([C@H]1CC[C@@H]3CCCc4cccc1c43)CC2

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
OPRL1 P41146 20/20 1.00
OPRM1 P35372 19/20 1.00
OPRK1 P41145 19/20 1.00
OPRD1 P41143 17/20 1.00

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
SCHEMBL29579414 1.00 OPRL1 (1.00) OPRL1OPRM1OPRK1OPRD1
SCHEMBL15807233 1.00 OPRL1 (1.00) OPRL1OPRM1OPRK1OPRD1
SCHEMBL29707895 1.00 OPRL1 (1.00) OPRL1OPRM1OPRK1OPRD1
SCHEMBL2240264 1.00 OPRL1 (1.00) OPRL1OPRM1OPRK1OPRD1
SCHEMBL8186716 1.00 OPRL1 (1.00) OPRL1OPRM1OPRK1OPRD1
SCHEMBL3898784 1.00 OPRL1 (1.00) OPRL1OPRM1OPRK1OPRD1
Hydrochloric Acid SCHEMBL22408649 0.99 OPRL1 (0.98) OPRL1OPRM1OPRK1OPRD1
Hydrochloric Acid SCHEMBL7885527 0.99 OPRL1 (0.98) OPRL1OPRM1OPRK1OPRD1
Hydrochloric Acid SCHEMBL7883807 0.92 OPRL1 (0.84) OPRL1OPRM1OPRK1OPRD1
SCHEMBL6834468 0.87 OPRL1 (1.00) OPRL1OPRM1OPRK1OPRD1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140171466-A1 PAIN MANAGEMENT IN SICKLE CELL ANEMIA REGENTS OF THE UNIVERSITY OF MINNESOTA (US) 2014-06-19 US claimed
US-20030032651-A1 Intrathecal analgesia method OMEROS CORPORATION 2003-02-13 US claimed
US-20150290211-A1 PHARMACEUTICAL COMPOSITIONS LOCL PHARMA, INC. 2015-10-15 US disclosed
EP-1491212-B1 REMEDY FOR SLEEP DISTURBANCE MITSUBISHI TANABE PHARMA CORP (JP) 2012-08-08 EP disclosed
US-8003669-B2 Remedy for sleep disturbance MITSUBISHI TANABE PHARMA CORPORATION (JP) 2011-08-23 US disclosed
US-7737118-B2 Rotational intrathecal analgesia OMEROS CORPORATION (US) 2010-06-15 US disclosed
US-20090253747-A1 Remedy for sleep disturbance TESHIMA KOJI 2009-10-08 US disclosed
US-7566728-B2 Advance circadian rhythm disorders; using opioid receptor antagonist MITSUBISHI TANABE PHARMA CORPORATION (JP) 2009-07-28 US disclosed
US-20070299687-A1 Inpatient system for patient-controlled delivery of oral transmucosal medications dosed as needed ACELRX PHARMACEUTICALS, INC. 2007-12-27 US disclosed
US-20050119308-A1 Remedy for sleep disturbance MITSUBISHI TANABE PHARMA CORPORATION (JP) 2005-06-02 US disclosed
EP-1406629-A1 METHOD FOR INDUCING ANALGESIA COMPRISING ADMINISTRATION ALTERNATIVELY OF AN OPIOID RECEPTOR AGONIST AND AN OPIOID RECEPTOR LIKE RECEPTOR 1 AGONIST FOR AND AN IMPLANTABLE INFUSION PUMP Omeros Corporation (US) 2004-04-14 EP disclosed
US-20030040479-A1 Rotational intrathecal analgesia method and device OMEROS CORPORATION 2003-02-27 US disclosed
US-20030040486-A1 Rotational intrathecal analgesia REGENTS OF THE UNIVERSITY OF CALIFORNIA 2003-02-27 US disclosed
US-20030032651-A1 Intrathecal analgesia method OMEROS CORPORATION 2003-02-13 US disclosed
US-20030032651-A1 Intrathecal analgesia method OMEROS CORPORATION 2003-02-13 US disclosed
WO-2003004034-A1 METHOD FOR INDUCING ANALGESIA COMPRISING ADMINISTRATION ALTERNATIVELY OF AN OPIOID RECEPTOR AGONIST AND AN OPIOID RECEPTOR LIKE RECEPTOR 1 AGONIST FOR AND AN IMPLANTABLE INFUSION PUMP OMEROS CORPORATION (US) 2003-01-16 WO 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 (3 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-20050119308-A1 Remedy for sleep disturbance PER2, HCRTR1, HCRTR2 OPRL1 10/4885OPRM1 115/4885OPRK1 63/4885
US-20090253747-A1 Remedy for sleep disturbance PER2, HCRTR1, HCRTR2 OPRL1 10/4885OPRM1 115/4885OPRK1 63/4885
US-20140171466-A1 PAIN MANAGEMENT IN SICKLE CELL ANEMIA OPRL1, OPRM1, OPRK1 OPRL1 1/4885OPRM1 2/4885OPRK1 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.