Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BCAT2 | O15382 | 1/20 | 0.68 |
| ▸ | CYP2A6 | P11509 | 5/20 | 0.57 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.54 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.54 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.54 |
| ▸ | LMNA | P02545 | 1/20 | 0.54 |
| ▸ | MKNK1 | Q9BUB5 | 7/20 | 0.53 |
| ▸ | MKNK2 | Q9HBH9 | 7/20 | 0.53 |
| ▸ | LIMK1 | P53667 | 1/20 | 0.49 |
| ▸ | F7 | P08709 | 1/20 | 0.47 |
| ▸ | F3 | P13726 | 1/20 | 0.47 |
| ▸ | SARM1 | Q6SZW1 | 1/20 | 0.47 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.47 |
| ▸ | SIRT6 | Q8N6T7 | 1/20 | 0.47 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.47 |
| ▸ | SIRT3 | Q9NTG7 | 1/20 | 0.47 |
| ▸ | SIRT5 | Q9NXA8 | 1/20 | 0.47 |
| ▸ | SIRT4 | Q9Y6E7 | 1/20 | 0.47 |
| ▸ | CYP2E1 | P05181 | 2/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.46 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
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 | |
|---|---|---|---|---|
| SCHEMBL27691411 | 0.85 | CYP2A6 (0.58) | BCAT2CYP2A6CYP3A4CYP2C19CYP1A2 | |
| SCHEMBL6667283 | 0.81 | BCAT2 (0.69) | BCAT2IKBKBALDH1A1CHEK2 | |
| SCHEMBL4445671 | 0.81 | BCAT2 (1.00) | BCAT2CYP3A4CYP1A2LMNACYP2C9 | |
| SCHEMBL27691396 | 0.80 | GABRA1 (0.60) | CYP2A6CYP3A4CYP2C19CYP1A2CYP2E1 | |
| Hydrochloric Acid SCHEMBL31228833 | 0.80 | BCAT2 (0.96) | BCAT2CYP3A4CYP1A2LMNACYP2C9 | |
| SCHEMBL4221979 | 0.77 | CYP2A6 (0.57) | CYP2A6CYP3A4CYP2C19CYP1A2LMNA | |
| SCHEMBL31661826 | 0.77 | BCAT2 (0.54) | BCAT2CYP2A6CYP3A4CYP2C19CYP1A2 | |
| SCHEMBL31661861 | 0.77 | BCAT2 (0.54) | BCAT2CYP3A4CYP2C19CYP1A2MKNK2 | |
| SCHEMBL31661900 | 0.76 | BCAT2 (0.57) | BCAT2CYP3A4CYP2C19CYP1A2LMNA | |
| SCHEMBL27711486 | 0.76 | BCAT2 (0.49) | BCAT2CYP2A6CYP1A2LIMK1F7 |
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 12 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112004807-B | Compounds and pharmaceutical compositions comprising the same | 自体吞噬科学有限公司 | 2023-07-18 | — | — | CN | claimed |
| CN-112004807-A | Novel compounds and pharmaceutical compositions comprising said compounds | 自体吞噬科学有限公司 | 2020-11-27 | — | — | CN | claimed |
| CN-101098870-B | Novel fused imidazole derivative | BANYU PHARMA CO LTD | 2010-11-03 | — | — | CN | claimed |
| CN-101098870-A | Novel fused imidazole derivative | BANYU PHARMA CO LTD (JP) | 2008-01-02 | — | — | CN | claimed |
| CN-1400973-A | Novel biarylcarboxamides | ASTRAZENECA AB (SE) | 2003-03-05 | — | — | CN | claimed |
| WO-2025151311-A1 | NICOTINAMIDE DERIVATIVES | BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) | 2025-07-17 | — | — | WO | disclosed |
| CN-112004807-B | Compounds and pharmaceutical compositions comprising the same | 自体吞噬科学有限公司 | 2023-07-18 | — | — | CN | disclosed |
| CN-112004807-A | Novel compounds and pharmaceutical compositions comprising said compounds | 自体吞噬科学有限公司 | 2020-11-27 | — | — | CN | disclosed |
| CN-101098870-B | Novel fused imidazole derivative | BANYU PHARMA CO LTD | 2010-11-03 | — | — | CN | disclosed |
| CN-101098870-A | Novel fused imidazole derivative | BANYU PHARMA CO LTD (JP) | 2008-01-02 | — | — | CN | disclosed |
| EP-1453828-A2 | AZABICYCLIC COMPOUNDS FOR THE TREATMENT OF FIBROMYALGIA SYNDROME | AstraZeneca AB (SE) | 2004-09-08 | — | — | EP | disclosed |
| WO-2003032897-A2 | AZABICYCLIC COMPOUNDS FOR THE TREATMENT OF FIBROMYALGIA SYNDROME | ASTRAZENECA AB (SE) | 2003-04-24 | — | — | WO | disclosed |