⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL21222594 | 1.00 | — | — | |
| SCHEMBL7764143 | 1.00 | — | — | |
| SCHEMBL18949625 | 0.78 | — | — | |
| SCHEMBL23340179 | 0.75 | — | — | |
| SCHEMBL3750012 | 0.75 | ALDH1A1 (0.36) | — | |
| SCHEMBL3760053 | 0.75 | — | — | |
| SCHEMBL9534584 | 0.75 | ALDH1A1 (0.36) | — | |
| SCHEMBL3760051 | 0.75 | — | — | |
| SCHEMBL3750007 | 0.75 | ALDH1A1 (0.36) | — | |
| SCHEMBL9534588 | 0.75 | ALDH1A1 (0.36) | — |
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.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-4182470-A | — | — | None | — | — | JP | disclosed |
| US-11053234-B2 | 1,3 di-substituted cyclobutane or azetidine derivatives as hematopoietic prostaglandin D synthase inhibitors | GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) | 2021-07-06 | — | — | US | disclosed |
| US-20190241554-A1 | 1,3 DI-SUBSTITUTED CYCLOBUTANE OR AZETIDINE DERIVATIVES AS HEMATOPOIETIC PROSTAGLANDIN D SYNTHASE INHIBITORS | GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) | 2019-08-08 | — | — | US | disclosed |
| US-20090018150-A1 | 5-Ht2b Receptor Antagonists | ASTERAND UK LIMITED (GB) | 2009-01-15 | — | — | US | disclosed |
| EP-0665222-B1 | Guanidine derivatives, their production and insecticides | TAKEDA CHEMICAL INDUSTRIES LTD (JP) | 2001-06-20 | — | — | EP | disclosed |
| US-5633375-A | NONTOXIC TO HUMNAS, ANIMALS, FISH | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1997-05-27 | — | — | US | disclosed |
| US-5489603-A | CONTAINING NITROGEN HETEROCYCLIC RINGS | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1996-02-06 | — | — | US | disclosed |
| EP-0493369-B1 | Guanidine derivatives, their production and insecticides | TAKEDA CHEMICAL INDUSTRIES LTD (JP) | 1995-11-08 | — | — | EP | disclosed |
| EP-0665222-A1 | Guanidine derivatives, their production and insecticides | Takeda Chemical Industries, Ltd. (JP) | 1995-08-02 | — | — | EP | disclosed |
| US-5384324-A | Insecticidally active cyano compounds | NIHON BAYER AGROCHEM K.K. (JP) | 1995-01-24 | — | — | US | disclosed |
| EP-0376279-A2 | Guanidine derivatives, their production and insecticides | Takeda Chemical Industries, Ltd. (JP) | 1990-07-04 | — | — | EP | disclosed |
| EP-0364844-A1 | Insecticidally active cyano compounds | NIHON BAYER AGROCHEM K.K. (JP) | 1990-04-25 | — | — | EP | disclosed |
| EP-0046635-B1 | PROCESS FOR THE PREPARATION OF CIMETIDINE | ORION-YHTYMÄ OY (FI) | 1985-07-03 | — | — | EP | disclosed |
| EP-0030835-B1 | DERIVATIVES OF 2-SUBSTITUTED-6-PHENYL-3(2H)PYRIDAZINONE, THEIR PRODUCTION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | MORISHITA PHARMACEUTICAL CO. LTD. (JP) | 1983-05-11 | — | — | EP | disclosed |
| US-4372963-A | HISTAMINE ANTAGONISTS | SMITH KLINE & FRENCH LABORATORIES LIMITED (GB) | 1983-02-08 | — | — | US | disclosed |
| EP-0046635-A1 | Process for the preparation of cimetidine | ORION-YHTYMÄ OY (FI) | 1982-03-03 | — | — | EP | disclosed |
| US-4285952-A | Pyridyl, thiazolyl and isothiazolyl alkyl bisamidines | SMITH KLINE & FRENCH LABORATORIES LIMITED (GB) | 1981-08-25 | — | — | US | disclosed |
| EP-0030835-A1 | Derivatives of 2-substituted-6-phenyl-3(2H)pyridazinone, their production and pharmaceutical compositions containing them | MORISHITA PHARMACEUTICAL CO. LTD. (JP) | 1981-06-24 | — | — | EP | disclosed |
| US-4212875-A | ANTIHISTAMINES | SMITH KLINE & FRENCH LABORATORIES LIMITED (GB) | 1980-07-15 | — | — | US | disclosed |
| US-4141899-A | ANTIULCER, ANTISECRETORY | SOCIETA' FARMACEUTICI ITALIA S.P.A. (IT) | 1979-02-27 | — | — | US | disclosed |