⚠ 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 | |
|---|---|---|---|---|
| Propiolic Acid SCHEMBL9127486 | 0.87 | — | — | |
| Propiolic Acid SCHEMBL5308405 | 0.85 | — | — | |
| Propiolic Acid SCHEMBL28619838 | 0.84 | — | — | |
| Propiolic Acid SCHEMBL4192977 | 0.82 | CA1 (0.36) | — | |
| Propiolic Acid SCHEMBL1077 | 0.82 | — | — | |
| Propiolic Acid SCHEMBL17554261 | 0.79 | HSD17B10 (0.46) | — | |
| Propiolic Acid SCHEMBL28876858 | 0.79 | — | — | |
| Propiolic Acid SCHEMBL28619867 | 0.79 | — | — | |
| Propiolic Acid SCHEMBL5148173 | 0.79 | — | — | |
| Propiolic Acid SCHEMBL1569415 | 0.78 | — | — |
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 12 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-10786542-B2 | Methods and compositions for modulating transport of a drug | LASKIN JEFFREY D (US) | 2020-09-29 | — | — | US | disclosed |
| US-20190336564-A1 | METHODS AND COMPOSITIONS FOR MODULATING TRANSPORT OF A DRUG | LASKIN JEFFREY D (US) | 2019-11-07 | — | — | US | disclosed |
| US-10376556-B2 | Methods and compositions for modulating transport of a drug | LASKIN JEFFREY D (US) | 2019-08-13 | — | — | US | disclosed |
| US-20180104302-A1 | METHODS AND COMPOSITIONS FOR MODULATING TRANSPORT OF A DRUG | LASKIN JEFFREY D (US) | 2018-04-19 | — | — | US | disclosed |
| US-9849155-B1 | Methods and compositions for modulating transport of a drug | LASKIN JEFFREY D (US) | 2017-12-26 | — | — | US | disclosed |
| US-20010044534-A1 | Pyrimidine derivative salt | CENTRAL GLASS COMPANY, LIMITED (JP) | 2001-11-22 | — | — | US | disclosed |
| EP-0150507-B1 | CEPHALOSPORIN DERIVATIVES, PROCESSES FOR PRODUCING THE SAME AND COMPOSITIONS CONTAINING THEM | MOCHIDA PHARMACEUTICAL CO., LTD. (JP) | 1992-08-05 | — | — | EP | disclosed |
| US-5064953-A | INTERMEDIATES CEPHALOSPORIN DERIVATIVES | MOCHIDA PHARMACEUTICAL CO., LTD. (JP) | 1991-11-12 | — | — | US | disclosed |
| US-4888332-A | ANTIBIOTICS | MOCHIDA PHARMACEUTICAL CO., LTD. (JP) | 1989-12-19 | — | — | US | disclosed |
| EP-0150507-A2 | Cephalosporin derivatives, processes for producing the same and compositions containing them | MOCHIDA PHARMACEUTICAL CO., LTD. (JP) | 1985-08-07 | — | — | EP | disclosed |
| US-4309428-A | Maytansinoids | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1982-01-05 | — | — | US | disclosed |
| EP-0025496-A1 | Maytansinoids, their production and therapeutic compositions containing them | Takeda Chemical Industries, Ltd. (JP) | 1981-03-25 | — | — | EP | disclosed |