⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7735640 | 0.85 | TSHR (0.31) | — | |
| SCHEMBL8318077 | 0.85 | — | — | |
| SCHEMBL22228981 | 0.85 | — | — | |
| SCHEMBL236720 | 0.83 | — | — | |
| SCHEMBL9230924 | 0.82 | — | — | |
| SCHEMBL3022 | 0.80 | — | — | |
| SCHEMBL11203180 | 0.80 | — | — | |
| SCHEMBL969229 | 0.80 | — | — | |
| SCHEMBL10617622 | 0.79 | — | — | |
| SCHEMBL7439608 | 0.78 | TSHR (0.33) | — |
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 135 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-10981939-B2 | Process for the preparation of 4-[(1-hydroxy-1,3-dihydro-2,1-benzoxaborol-5-yl) oxy] benzonitrile (Crisaborole) | BIOPHORE INDIA PHARMACEUTICALS PVT. LTD. (IN) | 2021-04-20 | — | — | US | claimed |
| US-20200062785-A1 | NOVEL PROCESS FOR THE PREPARATION OF 4-[(1-HYDROXY-1,3-DIHYDRO-2,1-BENZOXABOROL-5-YL) OXY] BENZONITRILE (CRISABOROLE) | BIOPHORE INDIA PHARMACEUTICALS PVT. LTD., (IN) | 2020-02-27 | — | — | US | claimed |
| WO-2018207216-A1 | NOVEL PROCESS FOR THE PREPARATION OF 4-[(1-HYDROXY-1,3-DIHYDRO-2,1-BENZOXABOROL-5-YL) OXY] BENZONITRILE (CRISABOROLE) | BIOPHORE INDIA PHARMACEUTICALS PVT. LTD. (IN) | 2018-11-15 | — | — | WO | claimed |
| EP-0581980-B1 | 3- and/or 4-substituted derivatives of quinic acid and process to prepare 3- and/or 4-substituted derivatives of quinic acid | NESTLE SA (CH) | 1999-03-03 | — | — | EP | claimed |
| EP-0581979-B1 | Quinic acid derivatives and process to prepare quinic acid derivatives | NESTLE SA (CH) | 1999-03-03 | — | — | EP | claimed |
| US-5446134-A | Reacting bis(fluorosulfonyl)methane salt with cyanogen halide or pseudohalide | CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) | 1995-08-29 | — | — | US | claimed |
| US-5401858-A | Preparation of quinic acid derivatives | NESTEC S.A. (CH) | 1995-03-28 | — | — | US | claimed |
| US-5395950-A | Production of quinic acid derivatives | NESTEC S.A. (CH) | 1995-03-07 | — | — | US | claimed |
| EP-0581980-A1 | 3- and/or 4-substituted derivatives of quinic acid and process to prepare 3- and/or 4-substituted derivatives of quinic acid | SOCIETE DES PRODUITS NESTLE S.A. (CH) | 1994-02-09 | — | — | EP | claimed |
| EP-0581979-A1 | Quinic acid derivatives and process to prepare quinic acid derivatives | SOCIETE DES PRODUITS NESTLE S.A. (CH) | 1994-02-09 | — | — | EP | claimed |
| US-20260034234-A1 | ANTIBODY DRUG CONJUGATES (ADC) THAT BIND TO 191P4D12 PROTEINS | AGENSYS, INC. (US) | 2026-02-05 | — | — | US | disclosed |
| EP-4615439-A2 | SOMATOSTATIN RECEPTOR SUBTYPE 4 (SSTR4) AGONISTS AND THEIR APPLICATIONS | Humanwell Pharmaceutical US, Inc. (US) | 2025-09-17 | — | — | EP | disclosed |
| EP-2970112-B1 | PHENYL CARBAMATE COMPOUND AND A COMPOSITION FOR PREVENTING OR TREATING A MEMORY LOSS-RELATED DISEASE COMPRISING THE SAME | BIO PHARM SOLUTIONS CO LTD (KR) | 2025-03-12 | — | — | EP | disclosed |
| EP-4423103-A1 | DNA-ENCODED AND AFFINITY-TAGGED MASKED-WARHEAD COMPOUNDS AND USE THEREOF IN ASSEMBLING LIBRARIES OF SMALL MOLECULES ENABLED FOR LATE-STAGE PURIFICATION AND MULTIPLEXED SCREENING OF COVALENT LIGANDS | Maianti, Juan Pablo (US) | 2024-09-04 | — | — | EP | disclosed |
| US-20240174693-A1 | SOMATOSTATIN RECEPTOR SUBTYPE 4 (SSTR4) AGONISTS AND THEIR APPLICATIONS | YICHANG HUMANWELL PHARMACEUTICALS CO., LTD. (CN) | 2024-05-30 | — | — | US | disclosed |
| WO-1993018018-A1 | PROCESS FOR THE PREPARATION OF TAXOL AND 10-DEACETYLTAXOL | UNIVERSITY OF FLORIDA (US) | 1993-09-16 | — | — | WO | disclosed |
| US-5200534-A | Process for the preparation of taxol and 10-deacetyltaxol | UNIVERSITY OF FLORIDA (US) | 1993-04-06 | — | — | US | disclosed |
| US-4960881-A | REACTING AMINO ACID WITH ALPHA-CHLORINATED CARBONATE IN SOLVENT IN PRESENCE OF ACID SCAVENGER | SOCIETE NATIONALE DES POUDRES ET EXPLOSIFS (FR) | 1990-10-02 | — | — | US | disclosed |
| US-4841043-A | Stereoselective synthesis of 1-β-alkyl carbapenem antibiotic intermediates | BRISTOL-MYERS COMPANY (US) | 1989-06-20 | — | — | US | disclosed |
| EP-0257419-A1 | Process for the preparation of antibacterial 7-oxo-4-thia-1-azabicyclo[3.2.0]hept-2-ene derivatives | HOECHST AKTIENGESELLSCHAFT (DE) | 1988-03-02 | — | — | EP | disclosed |