Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | APEX1 | P27695 | 1/20 | 0.31 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.30 |
| ▸ | CYP11B2 | P19099 | 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 | |
|---|---|---|---|---|
| SCHEMBL11684047 | 0.87 | TDP1 (0.39) | TSHRCYP3A4MAPK1TDP1 | |
| SCHEMBL23591340 | 0.82 | TDP1 (0.44) | TSHRCYP3A4MAPK1TDP1 | |
| SCHEMBL27339318 | 0.81 | TSHR (0.42) | TSHRCYP3A4MAPK1TDP1POLB | |
| SCHEMBL11601194 | 0.80 | CYP3A4 (0.35) | TSHRCYP3A4MAPK1TDP1 | |
| SCHEMBL7057611 | 0.79 | TSHR (0.46) | TSHRCYP3A4MAPK1TDP1POLB | |
| SCHEMBL7921991 | 0.79 | CYP11B1 (0.41) | CYP11B1CYP11B2 | |
| SCHEMBL30409600 | 0.78 | CYP3A4 (0.33) | TSHRCYP3A4MAPK1TDP1 | |
| SCHEMBL8975115 | 0.78 | CYP3A4 (0.33) | TSHRCYP3A4MAPK1TDP1 | |
| SCHEMBL15701548 | 0.77 | SMN1; SMN2 (0.38) | POLBAPEX1 | |
| SCHEMBL6353876 | 0.75 | TSHR (0.52) | TSHRCYP3A4MAPK1TDP1 |
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-104725221-B | The synthetic method of the chloro-5-fluorobenzoyl chloride of a kind of 2,4-bis- | ZHEJIANG BENLI CHEMICAL CO., LTD. (CN) | 2016-04-27 | — | — | CN | disclosed |
| CN-104725221-A | Method for synthesizing 2,4-dichloro-5-fluorobenzoyl | ZHEJIANG BENLI CHEMICAL CO LTD | 2015-06-24 | — | — | CN | disclosed |