⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8708031 | 0.72 | — | — | |
| SCHEMBL29622 | 0.69 | — | — | |
| SCHEMBL27977614 | 0.69 | ALDH1A1 (0.33) | — | |
| SCHEMBL5616890 | 0.68 | GRIK1 (0.36) | — | |
| Acrylamide SCHEMBL27801163 | 0.67 | ALDH1A1 (0.61) | — | |
| SCHEMBL28992671 | 0.67 | — | — | |
| SCHEMBL28147528 | 0.67 | — | — | |
| SCHEMBL22988 | 0.67 | — | — | |
| SCHEMBL458821 | 0.67 | — | — | |
| SCHEMBL6167960 | 0.67 | — | — |
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
Appears in 2293 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20240239794-A1 | PKC-Theta Modulators | EXSCIENTIA AI LIMITED (GB) | 2024-07-18 | — | — | US | claimed |
| CN-117794898-A | 3-pyrrolylsulfonamide compounds as GPR17 antagonists | 瑞文德医疗公众有限公司 | 2024-03-29 | — | — | CN | claimed |
| EP-4334316-A1 | PKC-THETA MODULATORS | Exscientia Al Limited (GB) | 2024-03-13 | — | — | EP | claimed |
| EP-4333982-A1 | PKC-THETA MODULATORS | Exscientia Al Limited (GB) | 2024-03-13 | — | — | EP | claimed |
| CN-117355507-A | Pyrimidine derivatives as LRRK2 kinase inhibitors | 哈利亚治疗公司 | 2024-01-05 | — | — | CN | claimed |
| WO-2023248255-A1 | BETA CARBOLINE ANALOGUES AS SELECTIVE AND BIASED KAPPA OPIOID RECEPTORS AGONISTS FOR TREATING VARIOUS ASSOCIATED PATHOPHYSIOLOGICAL CONDITIONS | COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) | 2023-12-28 | — | — | WO | claimed |
| CN-116963733-A | Imidazole compounds as ENPP1 inhibitors | 斯汀格瑞治疗股份有限公司 | 2023-10-27 | — | — | CN | claimed |
| EP-4247492-A1 | MALT-1 MODULATORS | Exscientia Al Limited (GB) | 2023-09-27 | — | — | EP | claimed |
| CN-116535365-A | Macrocyclic diamine derivatives and their combination with adenosine receptor antagonists as ENT inhibitors for the treatment of cancer | ITEOS比利时公司 | 2023-08-04 | — | — | CN | claimed |
| WO-2023147161-A2 | NICOTINATE AND NICOTINAMIDE RIBOSIDE-BASED COMPOUNDS AND DERIVATIVES THEREOF | New Frontier Bio, Inc. (US) | 2023-08-03 | — | — | WO | claimed |
| CN-86105509-A | Benzoates | — | 1987-02-11 | — | — | CN | claimed |
| EP-0086774-A1 | TREATMENT OF COCCIDIAL INFECTIONS WITH AMIDINOUREA OR AMIDINOTHIOUREA DERIVATIVES | RORER INTERNATIONAL (OVERSEAS) INC. (US) | 1983-08-31 | — | — | EP | claimed |
| WO-1983000625-A1 | TREATMENT OF COCCIDIAL INFECTIONS WITH AMIDINOUREA OR AMIDINOTHIOUREA DERIVATIVES | STUDT, WILLIAM, LYON | 1983-03-03 | — | — | WO | claimed |
| EP-0026221-A4 | DYSMENORRHEA TREATMENT. | RORER INC WILLIAM H (US) | 1981-08-27 | — | — | EP | claimed |
| US-4279928-A | Method of lowering blood pressure | WILLIAM H. RORER, INC. (US) | 1981-07-21 | — | — | US | claimed |
| EP-0026221-A1 | DYSMENORRHEA TREATMENT | WILLIAM H. RORER, INC. (US) | 1981-04-08 | — | — | EP | claimed |
| US-4241087-A | AMIDINOUREAS | WILLIAM H. RORER, INC. (US) | 1980-12-23 | — | — | US | claimed |
| US-4233241-A | LEUCO INDOANILINE DYES FOR HAIR | L'OREAL (FR) | 1980-11-11 | — | — | US | claimed |
| WO-1980002110-A1 | DYSMENORRHEA TREATMENT | RORER INC WILLIAM H (US) | 1980-10-16 | — | — | WO | claimed |
| US-4009271-A | 6-AZA-3H-1,4-BENZODIAZEPINES | DEUTSCHE GOLD- UND SILBER-SCHEIDEANSTALT VORMALS ROESSLER (DT) | 1977-02-22 | — | — | US | claimed |