SCHEMBL1972232

SCHEMBL1972232

c1ccc2c(c1)C1CNCC2C1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CHRNB4 P30926 7/20 1.00
CHRNA3 P32297 7/20 1.00
CHRNB2 P17787 16/20 0.59
CHRNA4 P43681 16/20 0.59
CHRNA1 P02708 2/20 0.52
CHRNG P07510 2/20 0.52
CHRNB1 P11230 2/20 0.52
CHRND Q07001 2/20 0.52

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
SCHEMBL30118728 1.00 CHRNB4 (1.00) CHRNB4CHRNA3CHRNB2CHRNA4CHRNA1
SCHEMBL13916010 1.00 CHRNB4 (1.00) CHRNB4CHRNA3CHRNB2CHRNA4CHRNA1
Hydrochloric Acid SCHEMBL1972897 0.97 CHRNB4 (0.95) CHRNB4CHRNA3CHRNB2CHRNA4CHRNA1
Hydrochloric Acid SCHEMBL29988071 0.97 CHRNB4 (0.95) CHRNB4CHRNA3CHRNB2CHRNA4CHRNA1
SCHEMBL11538560 0.84 CHRNB4 (0.72) CHRNB4CHRNA3CHRNB2CHRNA4
SCHEMBL2061331 0.84 CHRNB4 (0.73) CHRNB4CHRNA3CHRNB2CHRNA4
Hydrochloric Acid SCHEMBL11543466 0.83 CHRNB4 (0.69) CHRNB4CHRNA3CHRNB2CHRNA4
SCHEMBL11932910 0.81 CHRNB4 (0.68) CHRNB4CHRNA3CHRNB2CHRNA4CHRNA1
SCHEMBL5559162 0.75 CHRNB2 (1.00) CHRNB4CHRNA3CHRNB2CHRNA4
SCHEMBL5552804 0.75 CHRNB2 (1.00) CHRNB4CHRNA3CHRNB2CHRNA4CHRNA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111655695-B Substituted furopyrimidine compounds as PDE1 inhibitors 达特神经科学有限公司 2025-05-27 CN claimed
EP-3717488-A1 SUBSTITUTED FURANOPYRIMIDINE COMPOUNDS AS PDE1 INHIBITORS Dart NeuroScience, LLC (US) 2020-10-07 EP claimed
WO-2019104285-A1 SUBSTITUTED FURANOPYRIMIDINE COMPOUNDS AS PDE1 INHIBITORS DART NEUROSCIENCE, LLC (US) 2019-05-31 WO claimed
US-20130072682-A1 PROCESS FOR PREPARING VARENICLINE, VARENICLINE INTERMEDIATES, AND PHARMACEUTICALLY ACCEPTABLE SALTS THEREOF ACTAVIS GROUP PTC EHF (IS) 2013-03-21 US claimed
US-20110224437-A1 PROCESS FOR PREPARING VARENICLINE, VARENICLINE INTERMEDIATES, AND PHARMACEUTICALLY ACCEPTABLE SALTS THEREOF ACTAVIS GROUP PTC EHF (IS) 2011-09-15 US claimed
EP-2204369-A1 Process for preparing varenicline and intermediates for use therein Medichem, S.A. (ES) 2010-07-07 EP claimed
EP-1658059-A1 A PHARMACEUTICAL COMPOSITION FOR THE TREATMENT OF OBESITY OR TO FACILITATE OR PROMOTE WEIGHT LOSS Pfizer Products Inc. (US) 2006-05-24 EP claimed
EP-1658058-A1 A PHARMACEUTICAL COMPOSITION FOR THE PREVENTION AND TREATMENT OF ADDICTION IN A MAMMAL Pfizer Products Inc. (US) 2006-05-24 EP claimed
EP-1626738-A2 A PHARMACEUTICAL COMPOSITION FOR THE TREATMENT OF OBESITY OR TO FACILITATE OR PROMOTE WEIGHT LOSS Pfizer Products Inc. (US) 2006-02-22 EP claimed
US-20050250806-A1 Nicotinic acetylcholine receptor antagonists in the treatment of restless legs syndrome PFIZER INC 2005-11-10 US claimed
US-20020193360-A1 Use of GABAA inverse agonists in combination with nicotine receptor partial agonists, estrogen, selective estrogen modulators, or vitamin E for the treatment of cognitive disorders PFIZER INC. 2002-12-19 US claimed
US-20020016334-A1 Pharmaceutical composition for the treatment of attention deficit hyperactivity disorder (ADHD) COE JOTHAM WADSWORTH (US) 2002-02-07 US claimed
EP-1177798-A2 A pharmaceutical composition for the treatment of attention deficit hyperactivity disorder(ADHD) comprising a nicotine receptor partial agonist and anti-ADHD agent Pfizer Products Inc. (US) 2002-02-06 EP claimed
US-20020010192-A1 Pharmaceutical composition for the treatment of obesity or to facilitate or promote weight loss PFIZER INC. 2002-01-24 US claimed
EP-1159970-A2 A pharmaceutical composition for the treatment of obesity or to facilitate or promote weight loss, comprising a nicotine receptor partial agonist and an anti-obesity agent Pfizer Products Inc. (US) 2001-12-05 EP claimed
EP-1150715-A1 PHARMACEUTICAL COMPOSITIONS CONTAINING NICOTINE OR A LIGAND OF NICOTINE RECEPTORS AND A MONAMINE OXYDASE INHIBITOR AND THEIR USE FOR TREATING TOBACCO WITHDRAWAL SYMPTOMS SANOFI-SYNTHELABO (FR) 2001-11-07 EP claimed
US-20010036943-A1 Pharmaceutical composition for treatment of acute, chronic pain and/or neuropathic pain and migraines PFIZER PRODUCTS INC. 2001-11-01 US claimed
US-20010036949-A1 Pharmaceutical composition and method of treatment of diseases of cognitive dysfunction in a mammal PFIZER PRODUCTS INC. 2001-11-01 US claimed
EP-1078637-A2 Composition for the treatment and prevention of nicotine addiction containing a nicotine receptor agonist and an anti-depressant or anti-anxiety drug Pfizer Products Inc. (US) 2001-02-28 EP claimed
WO-2000045846-A1 PHARMACEUTICAL COMPOSITIONS CONTAINING NICOTINE OR A LIGAND OF NICOTINE RECEPTORS AND A MONAMINE OXYDASE INHIBITOR AND THEIR USE FOR TREATING TOBACCO WITHDRAWAL SYMPTOMS SANOFI-SYNTHELABO (FR) 2000-08-10 WO claimed

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

For each of this compound's patents that has machine-readable text (5 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-20110224437-A1 PROCESS FOR PREPARING VARENICLINE, VARENICLINE INTERMEDIATES, AND PHARMACEUTICALLY ACCEPTABLE SALTS THEREOF TET2, NOX4, CYP3A7 CHRNB4 296/4885CHRNA3 178/4885CHRNB2 114/4885
US-20020016334-A1 Pharmaceutical composition for the treatment of attention deficit hyperactivity disorder (ADHD) CHRNB4, CHRNA10, CHRNA7 CHRNB4 1/4885CHRNA3 12/4885CHRNB2 7/4885
US-20130072682-A1 PROCESS FOR PREPARING VARENICLINE, VARENICLINE INTERMEDIATES, AND PHARMACEUTICALLY ACCEPTABLE SALTS THEREOF TET2, NOX4, CYP3A7 CHRNB4 296/4885CHRNA3 178/4885CHRNB2 114/4885
US-20050250806-A1 Nicotinic acetylcholine receptor antagonists in the treatment of restless legs syndrome CHRNA5, CHRNA1, CHRNA2 CHRNB4 20/4885CHRNA3 7/4885CHRNB2 19/4885
US-20020193360-A1 Use of GABAA inverse agonists in combination with nicotine receptor partial agonists, estrogen, selective estrogen modulators, or vitamin E for the treatment of cognitive disorders CHRNE, CHRNA10, GABRE CHRNB4 11/4885CHRNA3 17/4885CHRNB2 15/4885

“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.