⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10827535 | 0.79 | — | — | |
| SCHEMBL1161632 | 0.77 | — | — | |
| SCHEMBL4721427 | 0.77 | — | — | |
| SCHEMBL4013189 | 0.77 | CA14 (0.32) | — | |
| SCHEMBL25390905 | 0.77 | — | — | |
| Isobutyramide SCHEMBL29045865 | 0.75 | BLM (0.42) | — | |
| Hydrochloric Acid SCHEMBL3506396 | 0.74 | CA14 (0.31) | — | |
| SCHEMBL8699790 | 0.74 | — | — | |
| SCHEMBL4730629 | 0.74 | — | — | |
| SCHEMBL162945 | 0.74 | TDP1 (0.38) | — |
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 49 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-118557747-A | Conjugates of cell binding molecules and camptothecin analogs | 杭州多禧生物科技有限公司 | 2024-08-30 | — | — | CN | claimed |
| US-20210330792-A1 | (BACTERIO)CHLOROPHYLL PHOTOSENSITIZERS FOR TREATMENT OF EYE DISEASES AND DISORDERS | YEDA RESEARCH AND DEVELOPMENT CO. LTD. (IL) | 2021-10-28 | — | — | US | claimed |
| US-20160354468-A1 | (BACTERIO)CHLOROPHYLL PHOTOSENSITIZERS FOR TREATMENT OF EYE DISEASES AND DISORDERS | YEDA RES & DEV (IL) | 2016-12-08 | — | — | US | claimed |
| JP-52109524-A | — | — | None | — | — | JP | disclosed |
| CN-114516824-A | Thioamide carboxylic ester and synthetic method thereof | 广州佳途科技股份有限公司 | 2022-05-20 | — | — | CN | disclosed |
| WO-2022086853-A1 | STAR POLYMER DRUG CONJUGATES | AVIDEA TECHNOLOGIES, INC. (US) | 2022-04-28 | — | — | WO | disclosed |
| CN-114315655-A | Sulfonation method of unsaturated alkane with electron-withdrawing group | 青岛科技大学 | 2022-04-12 | — | — | CN | disclosed |
| WO-2020214858-A1 | COMPOSITIONS AND METHODS OF MANUFACTURING STAR POLYMERS FOR LIGAND DISPLAY AND/OR DRUG DELIVERY | AVIDEA TECHNOLOGIES, INC. (US) | 2020-10-22 | — | — | WO | disclosed |
| CN-102858746-B | Novel 3,3-dimethyl tetrahydroquinoline derivatives | HOFFMANN LA ROCHE | 2014-07-16 | — | — | CN | disclosed |
| CN-102858746-A | Novel 3,3-dimethyl tetrahydroquinoline derivatives | HOFFMANN LA ROCHE | 2013-01-02 | — | — | CN | disclosed |
| US-20080125455-A1 | Condensed indoline derivatives and their use as 5HT, in particular 5HT2C, Receptor ligands | VERNALIS RESEARCH LIMITED | 2008-05-29 | — | — | US | disclosed |
| WO-2001012603-A1 | INDOLE DERIVATIVES, PROCESS FOR THEIR PREPARATION, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AND THEIR MEDICINAL APPLICATION | VERNALIS RESEARCH LIMITED (GB) | 2001-02-22 | — | — | WO | disclosed |
| WO-2001012602-A1 | CONDENSED INDOLINE DERIVATIVES AND THEIR USE AS 5HT, IN PARTICULAR 5HT2C, RECEPTOR LIGANDS | VERNALIS RESEARCH LIMITED (GB) | 2001-02-22 | — | — | WO | disclosed |
| WO-2000012475-A1 | INDOLINE DERIVATIVES AS 5-HT2B AND/OR 5-HT2C RECEPTOR LIGANDS | VERNALIS RESEARCH LIMITED (GB) | 2000-03-09 | — | — | WO | disclosed |
| WO-2000012502-A1 | PYRROLOQUINOLINES FOR TREATMENT OF OBESITY | VERNALIS RESEARCH LIMITED (GB) | 2000-03-09 | — | — | WO | disclosed |
| US-5858365-A | ADMINISTERING BUTYRIC ACID AND AN AMINO ACID, HEPTAFLUOROBUTYRIC ACID, 3-CHLOROPROPIONIC ACID, BETA-CHLORO-L-ALANINE HYDROCHLORIDE AND ISOBUTYRAMIDE FOR ULCERS | TRUSTEES OF BOSTON UNIVERSITY (US) | 1999-01-12 | — | — | US | disclosed |
| EP-0731712-A1 | PHYSIOLOGICALLY STABLE COMPOSITIONS OF BUTYRIC ACID, AND BUTYRIC ACID SALTS AND DERIVATIVES AS ANTI-NEOPLASTIC AGENTS | TRUSTEES OF BOSTON UNIVERSITY (US) | 1996-09-18 | — | — | EP | disclosed |
| WO-1995011699-A1 | PHYSIOLOGICALLY STABLE COMPOSITIONS OF BUTYRIC ACID, AND BUTYRIC ACID SALTS AND DERIVATIVES AS ANTI-NEOPLASTIC AGENTS | THE TRUSTEES OF BOSTON UNIVERSITY (US) | 1995-05-04 | — | — | WO | disclosed |
| US-4067738-A | PYRAZOLONE DYES, OXAZOLINE DYES | FUJI PHOTO FILM CO., LTD. | 1978-01-10 | — | — | US | disclosed |
| JP-S52109524-A | OXONOL DYE | FUJI PHOTO FILM CO LTD | 1977-09-13 | — | — | JP | disclosed |