⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL23501487 | 0.85 | TAAR1 (0.50) | — | |
| SCHEMBL577389 | 0.78 | CYP2A6 (0.43) | — | |
| SCHEMBL2142092 | 0.78 | ALDH1A1 (0.56) | — | |
| SCHEMBL3012 | 0.73 | — | — | |
| SCHEMBL5329192 | 0.72 | MAOA (0.46) | — | |
| Benzaldehyde SCHEMBL6690533 | 0.72 | ALDH1A1 (0.74) | — | |
| SCHEMBL4758209 | 0.72 | ABAT (0.52) | — | |
| Benzaldehyde SCHEMBL28468098 | 0.72 | ALDH1A1 (0.74) | — | |
| SCHEMBL460826 | 0.72 | IDO1 (0.58) | — | |
| SCHEMBL5999151 | 0.72 | ALDH1A1 (0.43) | — |
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 429 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2024130101-A1 | HYDROGEL COMPOSITIONS AND METHODS OF MAKING AND USING THE SAME | WAKE FOREST UNIVERSITY HEALTH SCIENCES (US) | 2024-06-20 | — | — | WO | claimed |
| CN-105916499-B | 12-epi-pleuromutilins | 纳布里瓦治疗股份公司 | 2020-02-18 | — | — | CN | claimed |
| CN-105916499-A | 12-epi-pleuromutilins | 纳布里瓦治疗股份公司 | 2016-08-31 | — | — | CN | claimed |
| CN-105722556-A | Improved antiperspirant compositions | 里曼贸易有限责任公司 | 2016-06-29 | — | — | CN | claimed |
| US-20150148394-A1 | ESTER PRO-DRUGS OF [3-(1-(1H-IMIDAZOL-4-YL)ETHYL)-2-METHYLPHENYL] METHANOL FOR TREATING SKIN DISEASES AND CONDITIONS | ALLERGAN INC (US) | 2015-05-28 | — | — | US | claimed |
| CN-101910168-B | Tropane compounds | EXELIXIS INC | 2014-07-30 | — | — | CN | claimed |
| EP-1658291-B1 | SUBSTITUTED 8-HETEROARYL XANTHINES | DOGWOOD PHARMACEUTICALS INC (US) | 2013-10-02 | — | — | EP | claimed |
| EP-2629777-A2 | BICYCLIC DIAMINES AS JANUS KINASE INHIBITORS | Merck Sharp & Dohme Corp. (US) | 2013-08-28 | — | — | EP | claimed |
| CN-102892492-A | Delivery particle | PROCTER & GAMBLE | 2013-01-23 | — | — | CN | claimed |
| WO-2012054364-A2 | BICYCLIC DIAMINES AS JANUS KINASE INHIBITORS | MERCK SHARP & DOHME CORP. (US) | 2012-04-26 | — | — | WO | claimed |
| WO-1994022840-A1 | SUBSTITUTED CAPROLACTAMS AND DERIVATIVES THEREOF USEFUL FOR TREATMENT OF HIV DISEASE | THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) | 1994-10-13 | — | — | WO | claimed |
| WO-1994019329-A1 | SUBSTITUTED CYCLIC CARBONYLS AND DERIVATIVES THEREOF USEFUL AS RETROVIRAL PROTEASE INHIBITORS | THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) | 1994-09-01 | — | — | WO | claimed |
| CN-1071577-A | Handle the toxicity of chemotherapy reagent and Anti-virus agent with acylated pyrimidine nucleosides | PRO NEURON INC (US) | 1993-05-05 | — | — | CN | claimed |
| EP-0190946-B1 | NOVEL CYCLIC HEXAPEPTIDE LHRH ANTAGONISTS | MERCK & CO. INC. (US) | 1993-01-20 | — | — | EP | claimed |
| EP-0206118-B1 | CYCLIC HEXAPEPTIDE SOMATOSTATIN ANALOGS, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | MERCK & CO. INC. (US) | 1992-07-22 | — | — | EP | claimed |
| US-4703034-A | HYPOGLYCEMIC AGENT | MERCK & CO., INC. (US) | 1987-10-27 | — | — | US | claimed |
| EP-0206118-A2 | Cyclic hexapeptide somatostatin analogs, process for their preparation and pharmaceutical compositions containing them | MERCK & CO. INC. (US) | 1986-12-30 | — | — | EP | claimed |
| US-4612366-A | Cyclic hexapeptide somatostatin analogs | MERCK & CO., INC. (US) | 1986-09-16 | — | — | US | claimed |
| US-4611054-A | GLUCAGON, GROWTH HORMONE AND INSULIN RELEASE INHIBITORS | MERCK & CO., INC. (US) | 1986-09-09 | — | — | US | claimed |
| EP-0190946-A2 | Novel cyclic hexapeptide LHRH antagonists | MERCK & CO. INC. (US) | 1986-08-13 | — | — | EP | claimed |