SCHEMBL6139409

SCHEMBL6139409

OCCCC1(c2ccc(Cl)c(Cl)c2)CCCNC1

nearest known ligand 0.85

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 20/20 0.85
SLC6A3 Q01959 17/20 0.85
SLC6A2 P23975 16/20 0.85
CYP2D6 P10635 1/20 0.79

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
SCHEMBL3466791 1.00 SLC6A4 (0.85) SLC6A4SLC6A3SLC6A2CYP2D6
Hydrochloric Acid SCHEMBL6543325 0.99 SLC6A4 (0.83) SLC6A4SLC6A3SLC6A2CYP2D6
SCHEMBL14415545 0.92 SLC6A4 (0.71) SLC6A4SLC6A3SLC6A2CYP2D6
SCHEMBL1981733 0.92 SLC6A4 (1.00) SLC6A4SLC6A3SLC6A2CYP2D6
SCHEMBL3466313 0.92 SLC6A4 (1.00) SLC6A4SLC6A3SLC6A2CYP2D6
SCHEMBL1981732 0.92 SLC6A4 (1.00) SLC6A4SLC6A3SLC6A2CYP2D6
Fumaric Acid SCHEMBL6139595 0.91 SLC6A4 (0.71) SLC6A4SLC6A3SLC6A2CYP2D6
Fumaric Acid SCHEMBL6139599 0.91 SLC6A4 (0.71) SLC6A4SLC6A3SLC6A2CYP2D6
SCHEMBL8458076 0.88 SLC6A4 (1.00) SLC6A4SLC6A3SLC6A2CYP2D6
SCHEMBL3466142 0.87 SLC6A4 (0.72) SLC6A4SLC6A3SLC6A2CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0888304-B1 SUBSTITUTED 3-ARYL-3-CARBOXYALKYL GLUTARAMIDES, METHOD FOR PREPARING SAME BY 4-ARYLO-4-CYANOHEPTANE DICARBOXYLIC ACID CYCLISATION, AND USE THEREOF FOR PREPARING 3-ARYL-3-HYDROXYALKYLPIPERIDINES SANOFI SYNTHELABO (FR) 2001-10-04 EP claimed
EP-0888304-A1 SUBSTITUTED 3-ARYL-3-CARBOXYALKYL GLUTARAMIDES, METHOD FOR PREPARING SAME BY 4-ARYLO-4-CYANOHEPTANE DICARBOXYLIC ACID CYCLISATION, AND USE THEREOF FOR PREPARING 3-ARYL-3-HYDROXYALKYLPIPERIDINES SANOFI (FR) 1999-01-07 EP claimed
WO-1997032852-A1 SUBSTITUTED 3-ARYL-3-CARBOXYALKYL GLUTARAMIDES, METHOD FOR PREPARING SAME BY 4-ARYLO-4-CYANOHEPTANE DICARBOXYLIC ACID CYCLISATION, AND USE THEREOF FOR PREPARING 3-ARYL-3-HYDROXYALKYLPIPERIDINES SANOFI (FR) 1997-09-12 WO claimed
WO-2023278843-A2 SOLID FORMS OF OSANETANT ACER THERAPEUTICS, INC. (US) 2023-01-05 WO disclosed
EP-1140842-B1 ALKYL ESTERS OF 3-(3,4-DIHALOGENOPHENYL)-2,6-DIOXOPIPERIDINE-3-PROPIONIC ACID USEFUL AS INTERMEDIATES SANOFI AVENTIS (FR) 2005-11-02 EP disclosed
US-6946269-B2 Alkyl esters of 3-(3,4-dihalophenyl)-2,6-dioxopiperidine-3-propionic acid of use as intermediates SANOFI-AVENTIS (FR) 2005-09-20 US disclosed
US-20040110796-A1 Alkyl esters of 3- (3,4-dihalophenyl) -2, 6 -di -oxopiperidine-3 -propionic acid of use as intermediates SANOFI-AVENTIS (FR) 2004-06-10 US disclosed
US-6686182-B2 ANTAGONISTS OF NATURAL KILLER CELL-3 RECEPTORS SANOFI-SYNTHELABO (FR) 2004-02-03 US disclosed
EP-1019373-B1 1-ACYL-3-PHENYL-3-(3-PIPERIDINOPROPYL)PIPERIDINE DERIVATIVES AS HUMAN NK3 RECEPTOR SELECTIVE ANTAGONISTS SANOFI SYNTHELABO (FR) 2003-11-12 EP disclosed
US-6602886-B2 3-alkyl-3-phenyl-piperidines WARNER-LAMBERT COMPANY 2003-08-05 US disclosed
US-20030073838-A1 3-alkyl-3-phenyl-piperidines CHEN MICHAEL HUAI GU (US) 2003-04-17 US disclosed
EP-1019373-A1 NOVEL HUMAN NK 3? RECEPTOR-SELECTIVE ANTAGONIST COMPOUNDS, METHOD FOR OBTAINING THEM AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM SANOFI-SYNTHELABO (FR) 2000-07-19 EP disclosed
US-6040316-A TACHYKININ ANTAGONISTS TREATING PAIN, DEPRESSION, ANXIETY, PANIC, SCHIZOPHRENIA, NEURALGIA, ADDICTION DISORDERS, INFLAMMATORY DISEASES, GASTROINTESTINAL DISORDERS, VASCULAR DISORDERS, AND NEUROPATHOLOGICAL DISORDERS WARNER-LAMBERT COMPANY (US) 2000-03-21 US disclosed
US-6008360-A Substituted 3-aryl-3-carboxyalkyl glutaramides, method for preparing same by 4-arylo-4-cyanoheptane dicarboxylic acid cyclisation, and use thereof for preparing 3-aryl-3-hydroxyalkylpiperidines SANOFI-SYNTHELABO (FR) 1999-12-28 US disclosed
EP-0915849-A2 PROCESS FOR THE PREPARATION OF 3,3-DISUBSTITUTED PIPERIDINES Smithkline Beecham S.p.A. (IT) 1999-05-19 EP disclosed
EP-0888304-A1 SUBSTITUTED 3-ARYL-3-CARBOXYALKYL GLUTARAMIDES, METHOD FOR PREPARING SAME BY 4-ARYLO-4-CYANOHEPTANE DICARBOXYLIC ACID CYCLISATION, AND USE THEREOF FOR PREPARING 3-ARYL-3-HYDROXYALKYLPIPERIDINES SANOFI (FR) 1999-01-07 EP disclosed
WO-1998005640-A2 PROCESS FOR THE PREPARATION OF 3,3-DISUBSTITUTED PIPERIDINES SMITHKLINE BEECHAM S.P.A. (IT) 1998-02-12 WO disclosed
WO-1997032852-A1 SUBSTITUTED 3-ARYL-3-CARBOXYALKYL GLUTARAMIDES, METHOD FOR PREPARING SAME BY 4-ARYLO-4-CYANOHEPTANE DICARBOXYLIC ACID CYCLISATION, AND USE THEREOF FOR PREPARING 3-ARYL-3-HYDROXYALKYLPIPERIDINES SANOFI (FR) 1997-09-12 WO disclosed
WO-1997010211-A1 NOVEL HUMAN NK3 RECEPTOR-SELECTIVE ANTAGONIST COMPOUNDS, METHOD FOR OBTAINING THEM AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM SANOFI (FR) 1997-03-20 WO disclosed
EP-0673928-A1 Novel N-(3,4-dichlorophenyl-propyl)-piperidine derivatives as selective human NK3-receptor antagonists SANOFI (FR) 1995-09-27 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-20040110796-A1 Alkyl esters of 3- (3,4-dihalophenyl) -2, 6 -di -oxopiperidine-3 -propionic acid of use as intermediates NAPEPLD, FFAR3, APEH SLC6A4 1230/4885SLC6A3 442/4885SLC6A2 1278/4885
US-20030073838-A1 3-alkyl-3-phenyl-piperidines TAC3, KCNK3, ACKR3 SLC6A4 89/4885SLC6A3 16/4885SLC6A2 269/4885

“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.