⚠ 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 | |
|---|---|---|---|---|
| Pyrrolidine SCHEMBL28527711 | 1.00 | ALDH1A1 (0.53) | — | |
| Piperidine SCHEMBL7344752 | 0.97 | ALDH1A1 (0.60) | — | |
| Piperidine SCHEMBL3283269 | 0.97 | ALDH1A1 (0.60) | — | |
| Piperidine SCHEMBL27445219 | 0.94 | ALDH1A1 (0.56) | — | |
| Azetidine SCHEMBL19586846 | 0.93 | — | — | |
| Urea SCHEMBL2677624 | 0.90 | SMN1; SMN2 (0.60) | — | |
| Pyrrolidine SCHEMBL1793163 | 0.90 | — | — | |
| Pyrrolidine SCHEMBL4076061 | 0.90 | ALDH1A1 (0.50) | — | |
| Pyrrolidine SCHEMBL15387295 | 0.90 | ALDH1A1 (0.50) | — | |
| Urea SCHEMBL1769303 | 0.89 | — | — |
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 39 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110290789-B | Bicyclic inhibitors of histone deacetylase | 罗丹疗法公司 | 2022-10-18 | — | — | CN | disclosed |
| US-11286256-B2 | Bicyclic inhibitors of histone deacetylase | ALKERMES, INC. (US) | 2022-03-29 | — | — | US | disclosed |
| EP-3570834-B1 | BICYCLIC INHIBITORS OF HISTONE DEACETYLASE | ALKERMES INC (US) | 2021-12-22 | — | — | EP | disclosed |
| EP-3464289-B1 | ULTRA-POTENT VINCA ALKALOIDS: ADDED MOLECULAR COMPLEXITY FURTHER DISRUPTS THE TUBULIN DIMER-DIMER INTERFACE | SCRIPPS RESEARCH INST (US) | 2021-04-21 | — | — | EP | disclosed |
| US-10975101-B2 | Ultra-potent vinca alkaloids: added molecular complexity further disrupts the tublin dimer-dimer interface | THE SCRIPPS RESEARCH INSTITUTE (US) | 2021-04-13 | — | — | US | disclosed |
| US-20210053964-A1 | BICYCLIC INHIBITORS OF HISTONE DEACETYLASE | JPMORGAN CHASE BANK, N.A. AS ADMINISTRATIVE AGENT | 2021-02-25 | — | — | US | disclosed |
| CN-107857755-B | N-pyrrolidinyl, N' -pyrazolyl-urea, thiourea, guanidine and cyanoguanidine compounds as TRKA kinase inhibitors | 阵列生物制药公司 | 2020-10-27 | — | — | CN | disclosed |
| US-20200317696-A1 | ULTRA-POTENT VINA ALKALOIDS: ADDED MOLECULAR COMPLEXITY FURTHER DISRUPTS THE TUBLIN DIMER-DIMER INTERFACE | NATIONAL INSTITUTES OF HEALTH | 2020-10-08 | — | — | US | disclosed |
| US-10696673-B2 | Bicyclic inhibitors of histone deacetylase | RODIN THERAPEUTICS, INC. (US) | 2020-06-30 | — | — | US | disclosed |
| US-20200148678-A1 | BICYCLIC INHIBITORS OF HISTONE DEACETYLASE | JPMORGAN CHASE BANK, N.A. AS ADMINISTRATIVE AGENT | 2020-05-14 | — | — | US | disclosed |
| WO-2004004665-A2 | SUBSTITUTED HETEROCYCLIC DERIVATIVES USEFUL AS ANTIDIABETIC AND ANTIOBESITY AGENTS AND METHOD | BRISTOL-MYERS SQUIBB COMPANY (US) | 2004-01-15 | — | — | WO | disclosed |
| WO-2001092240-A1 | NOVEL N-SUBSTITUTED PHENOTHIAZINES AND THEIR USE AS MODULATORS OF SERINE HYDROLASE ENZYMES | DALHOUSIE UNIVERSITY (CA) | 2001-12-06 | — | — | WO | disclosed |
| EP-0877017-B1 | Aminomethyl pyrrolidine urea compositions for the production of polyurethanes | AIR PROD & CHEM (US) | 2001-10-31 | — | — | EP | disclosed |
| EP-0877017-A1 | Aminomethyl pyrrolidine urea compositions for the production of polyurethanes | AIR PRODUCTS AND CHEMICALS, INC. (US) | 1998-11-11 | — | — | EP | disclosed |
| CN-1198436-A | Aminomethyl pyrrolidine urea compositions for production of polyurethanes | AIR PROD & CHEM (US) | 1998-11-11 | — | — | CN | disclosed |
| US-5756557-A | CATALYSTS IN THE PREPARATION OF POLYURETHANE FOAMS | AIR PRODUCTS AND CHEMICALS, INC. (US) | 1998-05-26 | — | — | US | disclosed |
| US-5288757-A | Aminosulfonyl urea ACAT inhibitors and a method of lowering blood cholesterol levels therewith | WARNER-LAMBERT COMPANY (US) | 1994-02-22 | — | — | US | disclosed |
| EP-0556322-A1 | AMINOSULFONYL UREA ACAT INHIBITORS. | WARNER LAMBERT CO (US) | 1993-08-25 | — | — | EP | disclosed |
| US-5214206-A | Anticholesterol agents, inhibitors of acylcoenzyme A | WARNER-LAMBERT COMPANY (US) | 1993-05-25 | — | — | US | disclosed |
| WO-1992008694-A1 | AMINOSULFONYL UREA ACAT INHIBITORS | WARNER-LAMBERT COMPANY (US) | 1992-05-29 | — | — | WO | disclosed |