⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5857032 | 0.97 | — | — | |
| SCHEMBL6535348 | 0.83 | — | — | |
| SCHEMBL1019049 | 0.81 | — | — | |
| SCHEMBL30082500 | 0.81 | MCL1 (0.33) | — | |
| SCHEMBL28626065 | 0.79 | CES2 (0.54) | — | |
| SCHEMBL28312201 | 0.79 | CES2 (0.54) | — | |
| SCHEMBL9743864 | 0.79 | CES2 (0.54) | — | |
| SCHEMBL2122905 | 0.75 | — | — | |
| SCHEMBL2121575 | 0.75 | CES2 (0.50) | — | |
| SCHEMBL13799020 | 0.73 | — | — |
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 50 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-10202345-B2 | Substituted azaspiro(4.5)decane derivatives | GRUENENTHAL GMBH (DE) | 2019-02-12 | — | — | US | claimed |
| EP-0417555-B1 | Pentamethine dyes and derivatives | BAYER AG (DE) | 1993-11-03 | — | — | EP | claimed |
| US-5118814-A | Pressure sensitive and heat sensitive recording media | BAYER AKTIENGESELLSCHAFT (DE) | 1992-06-02 | — | — | US | claimed |
| EP-0417555-A1 | Pentamethine dyes and derivatives | BAYER AG (DE) | 1991-03-20 | — | — | EP | claimed |
| EP-0370198-A1 | Tetraindolyl heptamethine derivatives | BAYER AG (DE) | 1990-05-30 | — | — | EP | claimed |
| EP-0010179-B1 | PROCESS FOR THE PREPARATION OF 2.2-DIALKYLPENTANE-1.5-DIAMINES, AND THE COMPOUNDS N-(4-CYANO-2.2-DIETHYLBUTYL)-4-CYANO-2.2-DIMETHYL BUTYLIDENE IMINE AND N-(4-CYANO-2-N-BUTYL-2-ETHYLBUTYL)-4-CYANO-2-N-BUTYL-2-ETHYL-BUTYLIDENE IMINE | Ruhrchemie Aktiengesellschaft (DE) | 1982-05-19 | — | — | EP | claimed |
| US-20250075147-A1 | FRAGRANCE AND FLAVOR COMPOSITIONS COMPRISING NEW FLAVOR AND FRAGRANCE INGREDIENTS | OSMO LABS, PBC | 2025-03-06 | — | — | US | disclosed |
| CN-118812519-A | Substituted tetrahydrofurans as Nav1.8 inhibitors | 武汉人福创新药物研发中心有限公司 | 2024-10-22 | — | — | CN | disclosed |
| CN-113614079-A | Crystals of heterocyclic amide compound and process for producing the same | 日产化学株式会社 | 2021-11-05 | — | — | CN | disclosed |
| WO-2021049932-A1 | PHOTO BIOCATALYTIC SYNTHESIS OF SECONDARY FATTY ALCOHOLS FROM UNSATURATED FATTY ACIDS | TECHNISCHE UNIVERSITEIT DELFT (NL) | 2021-03-18 | — | — | WO | disclosed |
| CN-107428702-A | Improved process for preparing statin precursors | 中化帝斯曼制药有限公司荷兰公司 | 2017-12-01 | — | — | CN | disclosed |
| WO-2017060873-A1 | SUBSTITUTED PYRAZOLO[3,4-B]PYRIDIN-6-CARBOXYLIC ACIDS AND THEIR USE | AbbVie S.à.r.l. (LU) | 2017-04-13 | — | — | WO | disclosed |
| US-20170012072-A1 | INFRARED SENSOR, NEAR-INFRARED ABSORBING COMPOSITION, CURED FILM, NEAR-INFRARED ABSORBING FILTER, IMAGE SENSOR, CAMERA MODULE, AND COMPOUND | FUJIFILM CORPORATION (JP) | 2017-01-12 | — | — | US | disclosed |
| EP-0417555-B1 | Pentamethine dyes and derivatives | BAYER AG (DE) | 1993-11-03 | — | — | EP | disclosed |
| US-5138070-A | Laser transfer printing; opticalrecording media | BAYER AKTIENGESELLSCHAFT (DE) | 1992-08-11 | — | — | US | disclosed |
| US-5118814-A | Pressure sensitive and heat sensitive recording media | BAYER AKTIENGESELLSCHAFT (DE) | 1992-06-02 | — | — | US | disclosed |
| EP-0370198-A1 | Tetraindolyl heptamethine derivatives | BAYER AG (DE) | 1990-05-30 | — | — | EP | disclosed |
| EP-0093338-A1 | Method for the preparation of cyanohydrine-carboxylic-acid esters | BAYER AG (DE) | 1983-11-09 | — | — | EP | disclosed |
| EP-0010179-A1 | Process for the preparation of 2.2-dialkylpentane-1.5-diamines, and the compounds N-(4-cyano-2.2-diethylbutyl)-4-cyano-2.2-dimethyl butylidene imine and N-(4-cyano-2-n-butyl-2-ethylbutyl)-4-cyano-2-n-butyl-2-ethyl-butylidene imine | Ruhrchemie Aktiengesellschaft (DE) | 1980-04-30 | — | — | EP | disclosed |
| US-4161491-A | Process for the production of alpha-ketocarboxylic acid amides and cycloaliphatic products | DEUTSCHE GOLD- UND SILBER-SCHEIDEANSTALT VORMALS ROESSLER (DE) | 1979-07-17 | — | — | US | disclosed |