⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11817088 | 0.97 | L3MBTL1 (0.36) | — | |
| SCHEMBL791126 | 0.80 | — | — | |
| SCHEMBL10809053 | 0.77 | — | — | |
| SCHEMBL11218995 | 0.77 | CXCR4 (0.39) | — | |
| SCHEMBL16767293 | 0.75 | DPP4 (0.36) | — | |
| SCHEMBL9545875 | 0.75 | L3MBTL1 (0.38) | — | |
| SCHEMBL18636775 | 0.73 | DPP4 (0.31) | — | |
| SCHEMBL609373 | 0.73 | DPP4 (0.33) | — | |
| SCHEMBL8936086 | 0.73 | — | — | |
| SCHEMBL11653000 | 0.73 | L3MBTL1 (0.41) | — |
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 10 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-11541051-B2 | Compositions and methods for treating CDK4/6-mediated cancer | ICAHN SCHOOL OF MEDICINE AT MOUNT SINAI (US) | 2023-01-03 | — | — | US | disclosed |
| US-20190336503-A1 | COMPOSITIONS AND METHODS FOR TREATING CDK4/6-MEDIATED CANCER | ICAHN SCHOOL OF MEDICINE AT MOUNT SINAI | 2019-11-07 | — | — | US | disclosed |
| EP-1474147-B1 | PYRIMIDINE-BASED COMPOUNDS USEFUL AS GSK-3 INHIBITORS | VERTEX PHARMA (US) | 2010-05-05 | — | — | EP | disclosed |
| US-20040063848-A1 | Oligomeric dyes and preparation thereof | 3M INNOVATIVE PROPERTIES COMPANY | 2004-04-01 | — | — | US | disclosed |
| WO-1993019226-A1 | LOW MELTING POLYALKYLENEPOLYAMINE CORROSION INHIBITORS | CHEVRON RESEARCH AND TECHNOLOGY COMPANY, A DIVISIO (US) | 1993-09-30 | — | — | WO | disclosed |
| US-4900458-A | Polyalkylenepolyamines as corrosion inhibitors | CHEVRON RESEARCH COMPANY (US) | 1990-02-13 | — | — | US | disclosed |
| WO-1988005039-A1 | POLYALKYLENEPOLYAMINES AS CORROSION INHIBITORS | CHEVRON RESEARCH COMPANY (US) | 1988-07-14 | — | — | WO | disclosed |
| US-4170591-A | INSECTICIDES, HERBICIDES AND FUNGICIDES | THE DOW CHEMICAL COMPANY (US) | 1979-10-09 | — | — | US | disclosed |
| US-4100187-A | Olefin-thionophosphine sulfide reaction products, their derivatives and use thereof as oil and fuel additives | EXXON RESEARCH & ENGINEERING CO. (US) | 1978-07-11 | — | — | US | disclosed |
| US-4042523-A | Olefin-thionophosphine sulfide reaction products, their derivatives and use thereof as oil and fuel additives | EXXON RESEARCH AND ENGINEERING CO. (US) | 1977-08-16 | — | — | US | disclosed |