⚠ 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL28510073 | 0.97 | — | — | |
| SCHEMBL18492843 | 0.80 | — | — | |
| SCHEMBL5886719 | 0.76 | TSHR (0.31) | — | |
| SCHEMBL15499154 | 0.73 | — | — | |
| SCHEMBL13669535 | 0.73 | — | — | |
| SCHEMBL16819057 | 0.72 | — | — | |
| SCHEMBL27713076 | 0.71 | TSHR (0.36) | — | |
| SCHEMBL10864153 | 0.71 | FDPS (0.41) | — | |
| SCHEMBL12967049 | 0.71 | — | — | |
| SCHEMBL12967348 | 0.71 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-105755119-A | PCR (polymerase chain reaction) hot-start method | 江西中大赛尔生物技术股份有限公司 | 2016-07-13 | — | — | CN | claimed |
| EP-0536369-B1 | 4-HYDROXY BUTYRIC ACID DERIVATIVES | KOEHLER CHEMIE DR FRANZ (DE) | 1995-11-15 | — | — | EP | claimed |
| CN-105755119-A | PCR (polymerase chain reaction) hot-start method | 江西中大赛尔生物技术股份有限公司 | 2016-07-13 | — | — | CN | disclosed |
| CN-104542033-A | Application of vanadate to improvement of soil cultivated plant drought resistant stress | UNIV KUNMING SCIENCE & TECHNOLOGY | 2015-04-29 | — | — | CN | disclosed |
| EP-0648203-B1 | NOVEL POLYIODINATED COMPOUNDS, PREPARATION THEREOF AND USE THEREOF AS RADIOLOGICAL CONTRAST AGENTS | GUERBET SA (FR) | 1998-11-18 | — | — | EP | disclosed |
| US-5817873-A | Polyiodinated compounds, their preparation and their use as contrast media for radiology | GUERBET S.A. (FR) | 1998-10-06 | — | — | US | disclosed |
| US-5609851-A | Compounds which can be used in contrast products for radiography | GUERBET S A. (FR) | 1997-03-11 | — | — | US | disclosed |