SCHEMBL508125

SCHEMBL508125

[2H]C([2H])([2H])CI

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL18911551 0.95
SCHEMBL13559951 0.78
SCHEMBL13559953 0.78
SCHEMBL508798 0.74
SCHEMBL5055 0.68
SCHEMBL16187034 0.68
SCHEMBL1332459 0.68
SCHEMBL1332288 0.68
SCHEMBL12160498 0.68
SCHEMBL11656036 0.68

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12325708-B2 Adenosine 2 receptor antagonists NEKTAR THERAPEUTICS (US) 2025-06-10 US disclosed
US-20250163026-A1 Deuterium-Enriched Nirmatrelvir as SARS-CoV-2 Mpro Inhibitor for the Treatment of COVID-19 DHANOA DALJIT SINGH (US) 2025-05-22 US disclosed
EP-3603674-B1 COMBINATION OF MORPHINAN COMPOUNDS AND ANTIDEPRESSANT FOR THE TREATMENT OF INTRACTABLE AND CHRONIC PAIN SUN PHARMACEUTICAL IND INC (US) 2025-02-26 EP disclosed
US-20230285387-A1 COMBINATION OF MORPHINAN COMPOUNDS AND ANTIDEPRESSANT FOR THE TREATMENT OF PSEUDOBULBAR AFFECT, NEUROLOGICAL DISEASES, INTRACTABLE AND CHRONIC PAIN AND BRAIN INJURY CONCERT PHARMACEUTICALS, INC. 2023-09-14 US disclosed
US-20220235056-A1 ADENOSINE 2 RECEPTOR ANTAGONISTS NEKTAR THERAPEUTICS 2022-07-28 US disclosed
US-20220023292-A1 COMBINATION OF MORPHINAN COMPOUNDS AND ANTIDEPRESSANT FOR THE TREATMENT OF PSEUDOBULBAR AFFECT, NEUROLOGICAL DISEASES, INTRACTABLE AND CHRONIC PAIN AND BRAIN INJURY CONCERT PHARMACEUTICALS, INC. 2022-01-27 US disclosed
WO-2020227156-A1 ADENOSINE 2 RECEPTOR ANTAGONISTS NEKTAR THERAPEUTICS (US) 2020-11-12 WO disclosed
US-10813926-B2 Morphinan compounds CONCERT PHARMACEUTICALS, INC. (US) 2020-10-27 US disclosed
EP-3603674-A1 COMBINATION OF MORPHINAN COMPOUNDS AND ANTIDEPRESSANT FOR THE TREATMENT OF INTRACTABLE AND CHRONIC PAIN CONCERT PHARMACEUTICALS, INC. (US) 2020-02-05 EP disclosed
US-10406155-B2 Morphinan compounds CONCERT PHARMACEUTICALS, INC. (US) 2019-09-10 US disclosed
US-20120029007-A1 MORPHINAN COMPOUNDS CONCERT PHARMACEUTICALS INC. 2012-02-02 US disclosed
EP-2397158-A2 Combination of morphinan compounds and antidepressant for the treatment of pseudobulbar affect CONCERT PHARMACEUTICALS, INC. (US) 2011-12-21 EP disclosed
US-20110282587-A1 COMPUTER READABLE STORAGE MEDIUMS, METHODS AND SYSTEMS FOR NORMALIZING CHEMICAL PROFILES IN BIOLOGICAL OR MEDICAL SAMPLES DETECTED BY MASS SPECTROMETRY EMORY UNIVERSITY (US) 2011-11-17 US disclosed
US-20110257214-A1 MORPHINAN COMPOUNDS SUN PHARMACEUTICAL INDUSTRIES, INC. 2011-10-20 US disclosed
EP-2365808-A1 COMBINATION OF MORPHINAN COMPOUNDS AND ANTIDEPRESSANT FOR THE TREATMENT OF PSEUDOBULBAR AFFECT, NEUROLOGICAL DISEASES, INTRACTABLE AND CHRONIC PAIN AND BRAIN INJURY Concert Pharmaceuticals Inc. (US) 2011-09-21 EP disclosed
EP-2334678-A1 MORPHINAN COMPOUNDS Concert Pharmaceuticals Inc. (US) 2011-06-22 EP disclosed
WO-2010062692-A1 COMBINATION OF MORPHINAN COMPOUNDS AND ANTIDEPRESSANT FOR THE TREATMENT OF PSEUDOBULBAR AFFECT, NEUROLOGICAL DISEASES, INTRACTABLE AND CHRONIC PAIN AND BRAIN INJURY CONCERT PHARMACEUTICALS INC. (US) 2010-06-03 WO disclosed
WO-2010033801-A1 MORPHINAN COMPOUNDS CONCERT PHARMACEUTICALS INC. (US) 2010-03-25 WO disclosed
WO-2004035517-A1 SPECIFIC MARKERS OF LIPID PEROXIDATION INSERM (FR) 2004-04-29 WO disclosed
EP-1411041-A1 Specific markers of lipid peroxidation INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE (INSERM) (FR) 2004-04-21 EP disclosed