⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7937935 | 1.00 | — | — | |
| SCHEMBL10414588 | 1.00 | — | — | |
| SCHEMBL2857141 | 0.92 | FDPS (0.43) | — | |
| SCHEMBL5068634 | 0.92 | FDPS (0.43) | — | |
| SCHEMBL5066598 | 0.92 | FDPS (0.43) | — | |
| SCHEMBL12491913 | 0.90 | FDPS (0.45) | — | |
| SCHEMBL9130650 | 0.90 | FDPS (0.45) | — | |
| SCHEMBL12491942 | 0.90 | FDPS (0.45) | — | |
| SCHEMBL16074821 | 0.90 | FDPS (0.45) | — | |
| SCHEMBL16074788 | 0.90 | FDPS (0.45) | — |
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 16 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4633025-A | INTERMEDIATES FOR SYNTHESIS OF PG ANALOGS | MILES LABORATORIES, INC. (US) | 1986-12-30 | — | — | US | claimed |
| EP-0198352-A2 | Method for preparing (+)R-2-methyl-hexane-1,2-diol | MILES INC. (US) | 1986-10-22 | — | — | EP | claimed |
| US-20130210704-A1 | NOVEL CYCLOSPORIN DERIVATIVES AND USES THEREOF | S&T GLOBAL INC. (US) | 2013-08-15 | — | — | US | disclosed |
| EP-0294749-B1 | PROCESS FOR PREPARING HIGHER ORDER CUPRATE COMPLEXES | G.D. Searle & Co. (US) | 1991-10-16 | — | — | EP | disclosed |
| US-5011958-A | Process for preparing higher order cuprate complexes | G. D. SEARLE & CO. (US) | 1991-04-30 | — | — | US | disclosed |
| US-4922032-A | Process for the preparation of optically active 2-methyl-1,2-hexanediols | CENTRO DE INVESTIGACION Y DE ESTUDIOS AVANZADOS DEL INSTITUTO POLITECNICO NACIONAL (MX) | 1990-05-01 | — | — | US | disclosed |
| EP-0198348-B1 | PROCESS FOR PREPARING (+)S-2-HYDROXY-2-METHYL-HEXANOIC ACID | MILES INC. (US) | 1990-01-03 | — | — | EP | disclosed |
| EP-0198352-A3 | METHOD FOR PREPARING (+)R-2-METHYL-HEXANE-1,2-DIOL | MILES INC. (US) | 1989-01-25 | — | — | EP | disclosed |
| EP-0294749-A1 | Process for preparing higher order cuprate complexes | G.D. Searle & Co. (US) | 1988-12-14 | — | — | EP | disclosed |
| US-4785124-A | Process for preparing higher order cuprate complexes | G. D. SEARLE & CO. (US) | 1988-11-15 | — | — | US | disclosed |
| US-4668822-A | Method for preparing (+)S-2--hydroxy-2-methyl-hexanoic acid | MILES LABORATORIES, INC. (US) | 1987-05-26 | — | — | US | disclosed |
| US-4633025-A | INTERMEDIATES FOR SYNTHESIS OF PG ANALOGS | MILES LABORATORIES, INC. (US) | 1986-12-30 | — | — | US | disclosed |
| US-4633025-A | INTERMEDIATES FOR SYNTHESIS OF PG ANALOGS | MILES LABORATORIES, INC. (US) | 1986-12-30 | — | — | US | disclosed |
| EP-0198352-A2 | Method for preparing (+)R-2-methyl-hexane-1,2-diol | MILES INC. (US) | 1986-10-22 | — | — | EP | disclosed |
| EP-0198352-A2 | Method for preparing (+)R-2-methyl-hexane-1,2-diol | MILES INC. (US) | 1986-10-22 | — | — | EP | disclosed |
| EP-0198348-A2 | Process for preparing (+)S-2-hydroxy-2-methyl-hexanoic acid | MILES INC. (US) | 1986-10-22 | — | — | EP | disclosed |