Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR2 | P41597 | 6/20 | 0.47 |
| ▸ | HTT | P42858 | 2/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | NOS3 | P29474 | 1/20 | 0.37 |
| ▸ | NOS1 | P29475 | 1/20 | 0.37 |
| ▸ | NOS2 | P35228 | 1/20 | 0.37 |
| ▸ | TMPRSS4 | Q9NRS4 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.36 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL18858411 | 1.00 | CCR2 (0.47) | CCR2HTTCYP3A4TSHRMAPK1 | |
| SCHEMBL25761353 | 0.84 | CCR2 (0.50) | CCR2HTTTMPRSS4CYP2D6CYP2C19 | |
| SCHEMBL23585275 | 0.79 | MEN1 (0.39) | CCR2MEN1HPGDALOX15KMT2A | |
| SCHEMBL27373627 | 0.78 | CES2 (0.46) | CCR2CYP3A4CYP2D6ALDH1A1RAB9A | |
| SCHEMBL18891501 | 0.78 | IDO1 (0.38) | CCR2SLC6A4HSD11B1 | |
| SCHEMBL18850253 | 0.74 | CCR2 (0.46) | CCR2HTTCYP3A4CYP2D6CYP2C19 | |
| SCHEMBL25795028 | 0.73 | CCR2 (0.38) | CCR2NOTUM | |
| SCHEMBL3789153 | 0.73 | CYP3A4 (0.52) | HTTCYP3A4TSHRMAPK1TDP1 | |
| SCHEMBL3787206 | 0.73 | CCR2 (0.46) | CCR2HTTCYP3A4MAPK1CYP2D6 | |
| SCHEMBL1492571 | 0.73 | CCR2 (0.36) | CCR2HTTTSHRTMPRSS4MEN1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-119654326-A | Novel heterocyclic compounds | 豪夫迈·罗氏有限公司 | 2025-03-18 | — | — | CN | disclosed |
| CN-118103374-A | Heterocyclic compounds | 豪夫迈·罗氏有限公司 | 2024-05-28 | — | — | CN | disclosed |