⚠ 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.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL9244246 | 0.95 | — | — | |
| Benzene SCHEMBL3704849 | 0.87 | TSHR (0.31) | — | |
| SCHEMBL28987001 | 0.78 | — | — | |
| SCHEMBL1235562 | 0.67 | — | — | |
| Hydrochloric Acid SCHEMBL10323675 | 0.63 | — | — | |
| SCHEMBL11082318 | 0.63 | — | — | |
| SCHEMBL23732 | 0.59 | — | — | |
| SCHEMBL8852489 | 0.59 | TSHR (0.54) | — | |
| SCHEMBL1328 | 0.59 | — | — | |
| SCHEMBL23546 | 0.59 | — | — |
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 53 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1729772-B1 | HETEROARYL PIPERIDINE GLYCINE TRANSPORTER INHIBITORS | MERCK SHARP & DOHME (US) | 2016-12-07 | — | — | EP | disclosed |
| CN-103534471-B | Device for dispensing an additive | FILTRAUTO (FR) | 2016-06-01 | — | — | CN | disclosed |
| CN-103534471-A | Device for dispensing an additive | FILTRAUTO SA | 2014-01-22 | — | — | CN | disclosed |
| CN-101084215-B | Piperidine and azetidine derivatives as GLYT1 inhibitors | MERCK SHARP & DOHME | 2013-10-30 | — | — | CN | disclosed |
| CN-101910179-B | Glucocorticoid receptor modulator and use method | LILLY CO ELI | 2013-06-19 | — | — | CN | disclosed |
| EP-1893566-B1 | CYCLOHEXANESULFONYL DERIVATIVES AS GLYT1 INHIBITORS TO TREAT SCHIZOPHRENIA | MERCK SHARP & DOHME (GB) | 2013-02-13 | — | — | EP | disclosed |
| EP-1891002-B1 | CYCLOHEXANESULFONYL DERIVATIVES AS GLYT1 INHIBITORS TO TREAT SCHIZOPHRENIA | MERCK SHARP & DOHME (GB) | 2012-05-30 | — | — | EP | disclosed |
| CN-1933836-B | Heteroaryl piperidine glycine transporter inhibitors | MERCK & CO INC | 2011-08-17 | — | — | CN | disclosed |
| US-7851638-B2 | Cyclohexanesulfonyl derivatives as GLYT1 inhibitors to treat schizophrenia | MERCK SHARP & DOHME LIMITED (GB) | 2010-12-14 | — | — | US | disclosed |
| CN-101910179-A | (e)-n-{3- [1-(8-fluoro-11h-10-oxa-1-aza-dibenzo [a,d] cycl0hepten-5ylidene)-propyl]-phenyl }-methynsulfon amide as glucocorticoid receptor modulator for the treatment of rheumatoid | LILLY CO ELI | 2010-12-08 | — | — | CN | disclosed |
| WO-1995016672-A1 | VITAMIN D AMINE AND AMIDE DERIVATIVES | HOLMES, MICHAEL, JOHN (GB) | 1995-06-22 | — | — | WO | disclosed |
| US-5369125-A | Cholesterol-lowering agents | MERCK & CO., INC. (US) | 1994-11-29 | — | — | US | disclosed |
| EP-0337167-B1 | 4-Aryl-4-piperidine (or pyrrolidine or hexahydroazepine) carbinols and heterocyclic analogs thereof | DU PONT MERCK PHARMA (US) | 1994-08-03 | — | — | EP | disclosed |
| WO-1994002134-A1 | CHOLESTEROL-LOWERING AGENTS | MERCK & CO., INC. (US) | 1994-02-03 | — | — | WO | disclosed |
| WO-1993021169-A1 | BENZOTHIAZOLE-SUBSTITUTED BENZYL ALCOHOLS AS LEUKOTRIENE ANTAGONISTS | MERCK FROSST CANADA INC. (CA) | 1993-10-28 | — | — | WO | disclosed |
| WO-1993021168-A1 | THIAZOLE-SUBSTITUTED BENZYL ALCOHOLS AS LEUKOTRIENE ANTAGONISTS | MERCK FROSST CANADA INC. (CA) | 1993-10-28 | — | — | WO | disclosed |
| US-5086063-A | Analgesics, antidepressants, anorexigenic agents | DU PONT MERCK PHARMACEUTICAL COMPANY (US) | 1992-02-04 | — | — | US | disclosed |
| CN-1054424-A | In a unique multi-function rotating reactor, implement the method and the spendable agitator of magnetic drive, particularly spendable agitator of magnetic drive in this reactor of the solid ingredient of synthetic Ziegler-type catalytic solid or this class catalytic solid | ELF AQUITAINE (FR) | 1991-09-11 | — | — | CN | disclosed |
| US-5019650-A | 4-aryl-4-piperidine (or pyrrolidine or hexahydroazepine) carbinols and heterocyclic analogs thereof | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 1991-05-28 | — | — | US | disclosed |
| EP-0337167-A1 | 4-Aryl-4-piperidine (or pyrrolidine or hexahydroazepine) carbinols and heterocyclic analogs thereof | THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) | 1989-10-18 | — | — | EP | disclosed |