⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8998607 | 1.00 | — | — | |
| SCHEMBL15431138 | 1.00 | — | — | |
| SCHEMBL10742592 | 0.95 | KMT2A (0.68) | — | |
| SCHEMBL8998761 | 0.86 | KMT2A (0.52) | — | |
| SCHEMBL8998766 | 0.86 | KMT2A (0.52) | — | |
| Geraniol SCHEMBL16346237 | 0.84 | KMT2A (0.83) | — | |
| SCHEMBL27539247 | 0.84 | KMT2A (0.65) | — | |
| Geraniol SCHEMBL16346238 | 0.84 | KMT2A (0.83) | — | |
| SCHEMBL8998539 | 0.84 | CYP3A4 (0.50) | — | |
| SCHEMBL8998543 | 0.84 | CYP3A4 (0.50) | — |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9546146-B2 | Migrastatins and uses thereof | SLOAN-KETTERING INSTITUTE FOR CANCER RESEARCH (US) | 2017-01-17 | — | — | US | disclosed |
| US-20160221984-A1 | MIGRASTATINS AND USES THEREOF | SLOAN-KETTERING INSTITUTE FOR CANCER RESEARCH | 2016-08-04 | — | — | US | disclosed |
| US-9303009-B2 | Migrastatins and uses thereof | SLOAN-KETTERING INSTITUTE FOR CANCER RESEARCH (US) | 2016-04-05 | — | — | US | disclosed |
| US-20140024705-A1 | MIGRASTATINS AND USES THEREOF | SLOAN-KETTERING INSTITUTE FOR CANCER RESEARCH (US) | 2014-01-23 | — | — | US | disclosed |
| EP-0258967-B2 | Process for producing optically active alcohols | TAKASAGO PERFUMERY CO LTD (JP) | 1996-08-21 | — | — | EP | disclosed |
| US-4962242-A | HYDROGENATING OLEFINIC ALCOHOL USING AS CATALYST A RUTHENIUM-OPTICALLY ACTIVE PHOSPHINE COMPLEX | TAKASAGO PERFUMERY CO., LTD. (JP) | 1990-10-09 | — | — | US | disclosed |
| EP-0258967-A2 | Process for producing optically active alcohols | Takasago Perfumery Co., Ltd. (JP) | 1988-03-09 | — | — | EP | disclosed |