⚠ 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 | |
|---|---|---|---|---|
| Cyclohexane SCHEMBL472747 | 1.00 | — | — | |
| Propane SCHEMBL18669883 | 1.00 | — | — | |
| Cyclopentane SCHEMBL12475383 | 1.00 | — | — | |
| Cyclohexane SCHEMBL8163399 | 0.94 | SHBG (0.32) | — | |
| Cyclopentane SCHEMBL12504359 | 0.88 | SHBG (0.30) | — | |
| Cyclohexane SCHEMBL12504167 | 0.88 | SHBG (0.30) | — | |
| Cyclohexane SCHEMBL2089641 | 0.84 | TP53 (0.33) | — | |
| Cyclohexane SCHEMBL472756 | 0.80 | CYP1A2 (0.37) | — | |
| Cyclopentane SCHEMBL472767 | 0.80 | — | — | |
| Cyclopentane SCHEMBL2317257 | 0.80 | CYP1A2 (0.37) | — |
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 352 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115340468-B | (R) -deuterated phenylalanine derivative and preparation method thereof | 西南大学 | 2023-10-24 | — | — | CN | claimed |
| CN-107735465-B | Ultraviolet curable and infrared light transmissive ink jet ink composition with improved high temperature resistance | 株式会社LG化学 | 2023-10-10 | — | — | CN | claimed |
| CN-114736247-B | Method for preparing 6-deoxy-talose | 浙江晟格生物科技有限公司 | 2023-08-25 | — | — | CN | claimed |
| CN-116178486-A | Asymmetric hydrogenation synthesis method and application of non-natural polypeptide | 西南大学 | 2023-05-30 | — | — | CN | claimed |
| CN-115945224-A | Impregnation method of hydrogenation catalyst | 中国石油化工股份有限公司 | 2023-04-11 | — | — | CN | claimed |
| CN-115340468-A | (R) -deuterated phenylalanine derivative and preparation method thereof | 西南大学 | 2022-11-15 | — | — | CN | claimed |
| CN-114644881-A | Coating resin composition for flexible cover window and flexible cover window using the same | UTI有限公司 | 2022-06-21 | — | — | CN | claimed |
| CN-114433133-A | Diesel oil ultra-deep hydrodesulfurization catalyst and preparation method thereof | 中国石油化工股份有限公司 | 2022-05-06 | — | — | CN | claimed |
| CN-108431748-B | Method for forming frame pattern using inkjet printing | 株式会社LG化学 | 2021-03-09 | — | — | CN | claimed |
| CN-112108159-A | Preparation method of distillate oil hydrotreating catalyst | 中国石油化工股份有限公司 | 2020-12-22 | — | — | CN | claimed |
| WO-2003066703-A1 | COMPOSITION FOR POLYURETHANE ELASTOMER HAVING HIGH HARDNESS AND EXCELLENT ABRASION RESISTANCE | SKC CO. LTD. (KR) | 2003-08-14 | — | — | WO | claimed |
| US-5145947-A | In the presence of a catalyst comprising palladium compound, non-hydrohalogenic acid and phosphorous ligand | SHELL OIL COMPANY (US) | 1992-09-08 | — | — | US | claimed |
| US-5091506-A | POLYMERIZATION OF CARBON MONOXIDE/NORBORNENE WITH P BIDENTATE LIGAND | SHELL OIL COMPNAY (US) | 1992-02-25 | — | — | US | claimed |
| US-5071916-A | Molding materials having improved toughness and impact strength; materials handling | SHELL OIL COMPANY (US) | 1991-12-10 | — | — | US | claimed |
| EP-0372761-A2 | Process for separating extractable organic material from compositions comprising said extractable organic material intermixed with solids and water | THE STANDARD OIL COMPANY (US) | 1990-06-13 | — | — | EP | claimed |
| EP-0003040-B1 | LIGHT-SENSITIVE COATING MATERIAL AND PROCESS FOR THE PRODUCTION OF A NEGATIVE PHOTO RESIST IMAGE | International Business Machines Corporation (US) | 1983-09-07 | — | — | EP | claimed |
| US-4118440-A | Crosslinked vinyl halide polymers as flame retardant additives for thermoplastic polyester | STAUFFER CHEMICAL COMPANY (US) | 1978-10-03 | — | — | US | claimed |
| US-4049747-A | Crosslinked vinyl halide polymers as flame retardant additives for thermoplastics | STAUFFER CHEMICAL COMPANY (US) | 1977-09-20 | — | — | US | claimed |
| US-4022849-A | Crosslinked vinyl halide polymers as flame retardant additives for thermoplastics | STAUFFER CHEMICAL COMPANY (US) | 1977-05-10 | — | — | US | claimed |
| US-3965216-A | BIS(HYDROCARBYL) VINYL PHOSPHONATE | STAUFFER CHEMICAL COMPANY (US) | 1976-06-22 | — | — | US | claimed |