⚠ 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 | |
|---|---|---|---|---|
| Isopropyl Alcohol SCHEMBL3292218 | 0.87 | — | — | |
| Oxirane SCHEMBL27595280 | 0.87 | — | — | |
| Dioxane SCHEMBL4414289 | 0.83 | ALDH1A1 (0.50) | — | |
| Dioxane SCHEMBL27710851 | 0.80 | ALDH1A1 (0.46) | — | |
| Dioxane SCHEMBL8207440 | 0.80 | ALDH1A1 (0.46) | — | |
| Isopropyl Alcohol SCHEMBL5228428 | 0.77 | — | — | |
| Dioxane SCHEMBL2057757 | 0.77 | TTR (0.43) | — | |
| Isobutane SCHEMBL17026169 | 0.77 | — | — | |
| SCHEMBL124683 | 0.76 | — | — | |
| SCHEMBL3427685 | 0.76 | ALDH1A1 (0.62) | — |
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 13 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2013142969-A1 | URETHANES AND UREAS AND PROCESSES | GAO JIAN PING (CA) | 2013-10-03 | — | — | WO | disclosed |
| US-6403063-B1 | APPLYING POLYUREA; CURING | SAWYER KENNETH I (US) | 2002-06-11 | — | — | US | disclosed |
| US-6401724-B1 | POLYUREA-FORMING COMPOSITION SUCH AS 1)AN AMINOBENZOIC ACID ESTER OR AMIDE OF A POSSIBLY OLIGOMERIC POLYOL OR POLYAMINE OR AN AROMATIC DIAMINE AND 2)A POLYISOCYANATE | PAR PHARMACEUTICALS INCORPORATED | 2002-06-11 | — | — | US | disclosed |
| EP-0557506-B1 | PRINTING PLATE | POLAROID CORP (US) | 1998-11-04 | — | — | EP | disclosed |
| US-5407764-A | Plate for producing lithographic printing plate having substrate, polymeric photosensitive water insoluble hydrophilic and hydrophobic layers containing binders and compounds capable of promoting hardening when exposed to light | POLAROID CORPORATION (US) | 1995-04-18 | — | — | US | disclosed |
| US-5258263-A | Lithography printing, photosensitivity, polymerizable monomers and photoexposing | POLAROID CORPORATION (US) | 1993-11-02 | — | — | US | disclosed |
| EP-0557506-A1 | PRINTING PLATE | POLAROID CORPORATION (US) | 1993-09-01 | — | — | EP | disclosed |
| WO-1993005446-A1 | PRINTING PLATE | POLAROID CORPORATION (US) | 1993-03-18 | — | — | WO | disclosed |
| EP-0032547-B2 | POLYISOCYANATE POLYADDITION POLYMERS AND A PROCESS FOR THEIR PREPARATION | POLAROID CORPORATION (US) | 1989-07-26 | — | — | EP | disclosed |
| EP-0032547-B1 | POLYISOCYANATE POLYADDITION POLYMERS AND A PROCESS FOR THEIR PREPARATION | POLAROID CORPORATION (US) | 1985-02-06 | — | — | EP | disclosed |
| WO-1982001709-A1 | SYNTHETIC POLYMERS BY POLYISOCYANATE POLYADDITION PROCESS | POLAROID CORP (US) | 1982-05-27 | — | — | WO | disclosed |
| US-4328322-A | POLYUREA COPOLYMERS USING DIAMINO-SUBSTITUTED CARBO CARBOXYLIC ACID OR AMIDE-MODIFIED POLYETHERS OR POLYAMINES; CASTINGS; FOAMS | POLAROID CORPORATION (US) | 1982-05-04 | — | — | US | disclosed |
| EP-0032547-A2 | Polyisocyanate polyaddition polymers and a process for their preparation | POLAROID CORPORATION (US) | 1981-07-29 | — | — | EP | disclosed |