SCHEMBL231964

SCHEMBL231964

C1=CCC2CCNCC2=C1

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
SLC18A3 Q16572 1/20 0.32
SIGMAR1 Q99720 1/20 0.32

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
Hydrochloric Acid SCHEMBL28354165 0.98 SLC18A3 (0.31) SLC18A3SIGMAR1
SCHEMBL3828819 0.98 SLC18A3 (0.31) SLC18A3SIGMAR1
SCHEMBL29859614 0.82 SLC18A3 (0.35) SLC18A3SIGMAR1
SCHEMBL165871 0.79
SCHEMBL23223078 0.78
SCHEMBL28493181 0.78
Piperazine SCHEMBL27877942 0.73
SCHEMBL4754795 0.72
SCHEMBL11529807 0.69
SCHEMBL7380608 0.69

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112457247-A Synthesis method of dextromethorphan chiral intermediate 江苏宝众宝达药业有限公司 2021-03-09 CN claimed
US-8115002-B2 Preparation of substituted morphinan-6-ones and salts and intermediates thereof MALLINCKRODT LLC (US) 2012-02-14 US claimed
EP-2099764-B1 PREPARATION OF SUBSTITUTED MORPHINAN-6-ONES AND SALTS AND INTERMEDIATES THEREOF MALLINCKRODT INC (US) 2011-07-27 EP claimed
US-20100048906-A1 Preparation of Substituted Morphinan-6-Ones and Salts and Intermediates Thereof MALLINCKRODT PHARMACEUTICALS IRELAND LIMITED (IE) 2010-02-25 US claimed
EP-2149559-A1 A process for the preparation of hexahydroisoquinolines from 1,2,3,4-Tetrahydroisoquinolines Mallinckrodt Inc. (US) 2010-02-03 EP claimed
US-20090247756-A1 Process for the Preparation of Hexahydroisoquinolines from 1,2,3,4-Tetrahydroisoquinolines MALLINCKRODT INC. (US) 2009-10-01 US claimed
EP-2102163-A2 PREPARATION OF HEXAHYDROISOQUINOLINES FROM DIHYDROISOQUINOLINES Mallinckrodt Inc. (US) 2009-09-23 EP claimed
EP-2099764-A1 PREPARATION OF SUBSTITUTED MORPHINAN-6-ONES AND SALTS AND INTERMEDIATES THEREOF Mallinckrodt Inc. (US) 2009-09-16 EP claimed
WO-2008073389-A2 PREPARATION OF HEXAHYDROISOQUINOLINES FROM DIHYDROISOQUINOLINES MALLINCKRODT INC. (US) 2008-06-19 WO claimed
WO-2008036172-A1 PREPARATION OF SUBSTITUTED MORPHINAN-6-ONES AND SALTS AND INTERMEDIATES THEREOF MALLINCKRODT INC. (US) 2008-03-27 WO claimed
EP-1861373-A2 PROCESSES FOR PREPARING MORPHINANS AND INTERMEDIATES THEREOF MALLINCKRODT, INC. (US) 2007-12-05 EP claimed
WO-2006098855-A2 PROCESSES FOR PREPARING MORPHINANS AND INTERMEDIATES THEREOF MALLINCKRODT INC. (US) 2006-09-21 WO claimed
US-4368326-A Short total synthesis of dihydrothebainone, dihydrocodeinone, and nordihydroccodeinone UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE DEPARTMENT OF HEALTH AND HUMAN SERVICES 1983-01-11 US claimed
JP-10114775-A None JP disclosed
WO-2025201708-A1 INGRILIMINE AND DERIVATIVES, INVOLVEMENT IN NEURODEGENERATIVE DISEASES CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2025-10-02 WO disclosed
EP-4624457-A1 INGRILIMINE AND DERIVATIVES, INVOLVEMENT IN NEURODEGENERATIVE DISEASES Centre National de la Recherche Scientifique (FR) 2025-10-01 EP disclosed
US-4334070-A NEUROLEPTIC AGENTS HOFFMANN-LA ROCHE INC. (US) 1982-06-08 US disclosed
EP-0035244-A2 Cycloalka(4,5)pyrrolo(2,3-g)isoquinolines, processes and intermediates for their preparation, and medicines containing them F. HOFFMANN-LA ROCHE & CO. Aktiengesellschaft (CH) 1981-09-09 EP disclosed
US-4260762-A NEUROLEPTICS HOFFMANN-LA ROCHE INC. (US) 1981-04-07 US disclosed
EP-0010661-A2 Isoquinoline derivatives, process for their preparation, intermediates and pharmaceutical compositions containing them F. HOFFMANN-LA ROCHE & CO. Aktiengesellschaft (CH) 1980-05-14 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 (2 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-20090247756-A1 Process for the Preparation of Hexahydroisoquinolines from 1,2,3,4-Tetrahydroisoquinolines INF2, TYR, MDM2 SLC18A3 4210/4885SIGMAR1 3448/4885
US-20100048906-A1 Preparation of Substituted Morphinan-6-Ones and Salts and Intermediates Thereof CYP2D6, RTN4, UGT1A6 SLC18A3 1410/4885SIGMAR1 1873/4885

“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.