Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 1/20 | 0.65 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.58 |
| ▸ | TRPV1 | Q8NER1 | 2/20 | 0.53 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.50 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | TLR7 | Q9NYK1 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 2/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.47 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.46 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.45 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.45 |
| ▸ | LIPE | Q05469 | 2/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL10918711 | 0.83 | CYP11B1 (0.51) | TDP1TRPV1CYP11B1CYP11B2TLR7 | |
| SCHEMBL27460638 | 0.82 | MAPT (0.48) | KMT2ATDP1TRPV1CYP11B1CYP11B2 | |
| SCHEMBL10489212 | 0.82 | KMT2A (0.75) | KMT2ATDP1RAB9AMAPT | |
| SCHEMBL10413045 | 0.81 | MAPT (0.59) | KMT2ATDP1TRPV1CYP11B1CYP11B2 | |
| SCHEMBL11070724 | 0.81 | CYP11B1 (0.50) | TDP1TRPV1CYP11B1CYP11B2TLR7 | |
| SCHEMBL3444937 | 0.81 | KMT2A (0.72) | KMT2AMAPTL3MBTL1 | |
| SCHEMBL7247352 | 0.81 | PPARG (0.67) | KMT2ATDP1KDM4EMAPT | |
| SCHEMBL7487348 | 0.81 | KMT2A (0.46) | KMT2ATDP1TRPV1CYP11B1CYP11B2 | |
| SCHEMBL4602009 | 0.80 | ELANE (0.56) | CYP11B1CYP11B2TLR7RAB9ANPC1 | |
| SCHEMBL14955062 | 0.80 | CCR9 (0.52) | KMT2ATDP1TRPV1CYP11B1CYP11B2 |
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 |
|---|---|---|---|---|---|---|---|
| US-4446078-A | REACTING A POLYHALOALKOXY- OR POLYHALOALKYLTHIOBENZENE WITH A CARBOXYLIC DERIVATIVE, BORON TRIFLUORIDE | RHONE-POULENC SPECIALITES CHIMIQUES (FR) | 1984-05-01 | — | — | US | disclosed |
| US-4438043-A | Process for preparation of di- or trifluoromethoxyphenyl ketones or di- or trifluoromethylthiophenyl ketones | RHONE-POULENC SPECIALITES CHIMIQUES (FR) | 1984-03-20 | — | — | US | disclosed |