Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 3/20 | 0.40 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.33 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.33 |
| ▸ | CA12 | O43570 | 1/20 | 0.32 |
| ▸ | CA1 | P00915 | 1/20 | 0.32 |
| ▸ | CA9 | Q16790 | 1/20 | 0.32 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.31 |
| ▸ | AGXT | P21549 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL612513 | 0.94 | IDO1 (0.46) | IDO1CYP4F2CYP4A11CA12CA1 | |
| SCHEMBL2911886 | 0.91 | IDO1 (0.44) | IDO1CYP4F2CYP4A11CA12CA1 | |
| SCHEMBL25287039 | 0.89 | IDO1 (0.34) | IDO1 | |
| SCHEMBL31322887 | 0.84 | DAO (0.38) | IDO1 | |
| SCHEMBL14750162 | 0.84 | DAO (0.38) | IDO1 | |
| SCHEMBL1050358 | 0.83 | CA1 (0.33) | CA1 | |
| SCHEMBL16727024 | 0.82 | ACHE (0.36) | IDO1CYP4F2CYP4A11 | |
| SCHEMBL4059894 | 0.82 | IDO1 (0.33) | IDO1 | |
| SCHEMBL10969154 | 0.78 | TSHR (0.32) | IDO1 | |
| SCHEMBL23803913 | 0.78 | IDO1 (0.31) | IDO1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105399632-A | Synthetic method for 1,5-bis(chloromethyl)-3-fluorobenzene | UNIV CHANGZHOU | 2016-03-16 | — | — | CN | claimed |
| CN-105399632-A | Synthetic method for 1,5-bis(chloromethyl)-3-fluorobenzene | UNIV CHANGZHOU | 2016-03-16 | — | — | CN | disclosed |
| CN-105399632-A | Synthetic method for 1,5-bis(chloromethyl)-3-fluorobenzene | UNIV CHANGZHOU | 2016-03-16 | — | — | CN | disclosed |
| CN-105399632-A | Synthetic method for 1,5-bis(chloromethyl)-3-fluorobenzene | UNIV CHANGZHOU | 2016-03-16 | — | — | CN | disclosed |