Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 6/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.32 |
| ▸ | RECQL | P46063 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL7096749 | 0.93 | TSHR (0.53) | TSHRCYP3A4MAPK1TDP1ALDH1A1 | |
| SCHEMBL7928488 | 0.91 | TSHR (0.50) | TSHRCYP3A4MAPK1TDP1ALDH1A1 | |
| SCHEMBL1538847 | 0.86 | TSHR (0.47) | TSHRCYP3A4MAPK1TDP1 | |
| SCHEMBL7928485 | 0.83 | TSHR (0.44) | TSHRCYP3A4MAPK1TDP1 | |
| SCHEMBL10974819 | 0.77 | TSHR (0.33) | TSHRMAPK1TDP1TP53HIF1A | |
| SCHEMBL11611118 | 0.75 | TSHR (0.39) | TSHRCYP3A4ALDH1A1TP53 | |
| SCHEMBL196785 | 0.71 | TSHR (0.50) | TSHRCYP3A4MAPK1TDP1ALDH1A1 | |
| SCHEMBL3786224 | 0.71 | RAPGEF4 (0.47) | TSHRCYP3A4TDP1ALDH1A1HIF1A | |
| SCHEMBL10183607 | 0.71 | GABRA1 (0.52) | TSHRTDP1ALDH1A1HSD17B10 | |
| SCHEMBL4113569 | 0.71 | TSHR (0.55) | TSHRCYP3A4MAPK1TDP1ALDH1A1 |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6201152-B1 | HEATING MIXTURE OF METHYL-3,5-DICHLORO-4-METHYLBENZOATE AND ALPHA,ALPHA,ALPHA-TRICHLOROMETHYLBENZENE IN PRESENCE OF AMMONIUM MOLYBDATE CATALYST | OCCIDENTAL CHEMICAL CORPORATION | 2001-03-13 | — | — | US | claimed |
| US-4080378-A | REACTING A CARBOXYLIC ACID ESTER WITH A TRICHLOROMETHYL SUBSTITUTED AROMATIC COMPOUND IN THE PRESENCE OF A MOLYBDENUM CATALYST | DYNAMIT NOBEL AKTIENGESELLSCHAFT (DT) | 1978-03-21 | — | — | US | claimed |
| US-4079090-A | Preparation of trichloromethyl-trifluoro methyl-benzenes | BAYER AKTIENGESELLSCHAFT (DT) | 1978-03-14 | — | — | US | claimed |
| US-4163753-A | FROM AN ALIPHATIC ACID ANHYDRIDE AND A TRICHLOROMETHYL AROMATIC COMPOUND | Diaz Chemical Corporation (US) | 1979-08-07 | — | — | US | disclosed |
| US-4104300-A | MOLYBDENUM CATALYST, COMPLEXING AGENT | DYNAMIT NOBEL AKTIENGESELLSCHAFT (DE) | 1978-08-01 | — | — | US | disclosed |
| US-4080378-A | REACTING A CARBOXYLIC ACID ESTER WITH A TRICHLOROMETHYL SUBSTITUTED AROMATIC COMPOUND IN THE PRESENCE OF A MOLYBDENUM CATALYST | DYNAMIT NOBEL AKTIENGESELLSCHAFT (DT) | 1978-03-21 | — | — | US | disclosed |
| US-4079090-A | Preparation of trichloromethyl-trifluoro methyl-benzenes | BAYER AKTIENGESELLSCHAFT (DT) | 1978-03-14 | — | — | US | disclosed |