⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL25086836 | 0.85 | — | — | |
| SCHEMBL30488013 | 0.85 | — | — | |
| SCHEMBL25528158 | 0.81 | — | — | |
| SCHEMBL25831013 | 0.81 | — | — | |
| SCHEMBL12240494 | 0.81 | — | — | |
| SCHEMBL8348964 | 0.75 | ALDH1A1 (0.50) | — | |
| SCHEMBL3293547 | 0.72 | — | — | |
| SCHEMBL2120300 | 0.67 | — | — | |
| SCHEMBL16279841 | 0.67 | — | — | |
| SCHEMBL14282988 | 0.65 | NQO1 (0.33) | — |
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 24 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105304912-A | Preparation method of pyrimidine composite material used for fuel cell catalyst | UNIV XINJIANG | 2016-02-03 | — | — | CN | claimed |
| CN-106680265-A | Method for measuring concentration of hydrochloric acid generated in trichloromethane under ultrasonic wave condition | 新疆大学 | 2017-05-17 | — | — | CN | disclosed |
| CN-106543416-A | Polymer containing pyrimidine sulfuric acid concentration is detected in DMF solution in terms of application | 新疆大学 | 2017-03-29 | — | — | CN | disclosed |
| CN-105428665-A | Method for improving stability of catalyst | UNIV XINJIANG | 2016-03-23 | — | — | CN | disclosed |
| CN-105329881-A | Method for separating single-walled carbon nanotubes of different sizes by utilizing centrifugal speed variation method | UNIV XINJIANG | 2016-02-17 | — | — | CN | disclosed |
| US-9238651-B2 | 1-H-pyrrolo[2,3-b]pyridine derivatives | MERCK PATENT GMBH (DE) | 2016-01-19 | — | — | US | disclosed |
| US-9238651-B2 | 1-H-pyrrolo[2,3-b]pyridine derivatives | MERCK PATENT GMBH (DE) | 2016-01-19 | — | — | US | disclosed |
| US-9238651-B2 | 1-H-pyrrolo[2,3-b]pyridine derivatives | MERCK PATENT GMBH (DE) | 2016-01-19 | — | — | US | disclosed |
| US-20140371215-A1 | 1-H-Pyrrolo[2,3-b]Pyridine Derivatives | MERCK PATENT GMBH (DE) | 2014-12-18 | — | — | US | disclosed |
| US-20140371215-A1 | 1-H-Pyrrolo[2,3-b]Pyridine Derivatives | MERCK PATENT GMBH (DE) | 2014-12-18 | — | — | US | disclosed |
| US-20140100221-A1 | 1H-Pyrrolo[2,3-b]Pyridine Derivatives | MERCK PATENT GMBH (DE) | 2014-04-10 | — | — | US | disclosed |
| US-8664236-B2 | 1H-pyrrolo[2,3 b]-pyridine derivatives | MERCK PATENT GMBH (DE) | 2014-03-04 | — | — | US | disclosed |
| US-8664236-B2 | 1H-pyrrolo[2,3 b]-pyridine derivatives | MERCK PATENT GMBH (DE) | 2014-03-04 | — | — | US | disclosed |
| US-8664236-B2 | 1H-pyrrolo[2,3 b]-pyridine derivatives | MERCK PATENT GMBH (DE) | 2014-03-04 | — | — | US | disclosed |
| EP-2635574-A1 | 1H-PYRROLO[2,3-B]PYRIDINE DERIVATIVES | Merck Patent GmbH (DE) | 2013-09-11 | — | — | EP | disclosed |
| US-20130231519-A1 | 1H-Pyrrolo[2,3 b]pyridine derivatives | MERCK PATENT GMBH (DE) | 2013-09-05 | — | — | US | disclosed |
| US-20130231519-A1 | 1H-Pyrrolo[2,3 b]pyridine derivatives | MERCK PATENT GMBH (DE) | 2013-09-05 | — | — | US | disclosed |
| US-20130231519-A1 | 1H-Pyrrolo[2,3 b]pyridine derivatives | MERCK PATENT GMBH (DE) | 2013-09-05 | — | — | US | disclosed |
| WO-2012059172-A1 | 1H-PYRROLO[2,3-B]PYRIDINE DERIVATIVES | MERCK PATENT GMBH (DE) | 2012-05-10 | — | — | WO | disclosed |
| WO-2012059172-A1 | 1H-PYRROLO[2,3-B]PYRIDINE DERIVATIVES | MERCK PATENT GMBH (DE) | 2012-05-10 | — | — | WO | disclosed |