⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL17267279 | 0.81 | — | — | |
| SCHEMBL3483237 | 0.81 | — | — | |
| SCHEMBL4370106 | 0.79 | HSD17B10 (0.32) | — | |
| SCHEMBL17161322 | 0.77 | RGS12 (0.31) | — | |
| SCHEMBL29427561 | 0.74 | LMNA (0.31) | — | |
| SCHEMBL2169209 | 0.74 | LMNA (0.31) | — | |
| SCHEMBL8077101 | 0.73 | TAS1R3 (0.32) | — | |
| SCHEMBL30179538 | 0.73 | HDAC1 (0.39) | — | |
| SCHEMBL29250477 | 0.73 | LMNA (0.31) | — | |
| SCHEMBL3476705 | 0.72 | HSD17B10 (0.32) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20110137235-A1 | ULTRASONIC CANCER THERAPY ACCELERATOR | TOTO LTD. (JP) | 2011-06-09 | — | — | US | disclosed |
| US-20060002924-A1 | Conjugate of notch signalling pathway modulators and their use in medical treatment | CELLDEX THERAPEUTICS LIMITED (GB) | 2006-01-05 | — | — | US | disclosed |
| WO-2004060262-A2 | MODULATORS OF NOTCH SIGNALLING FOR USE IN IMMUNOTHERPAPY | LORANTIS LIMITED (GB) | 2004-07-22 | — | — | WO | disclosed |