Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 2/20 | 0.42 |
| ▸ | KCNN4 | O15554 | 4/20 | 0.39 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.38 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.38 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.38 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.38 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.33 |
| ▸ | KIF11 | P52732 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | USP2 | O75604 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | ACHE | P22303 | 1/20 | 0.31 |
| ▸ | MAOB | P27338 | 1/20 | 0.31 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.31 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL11537554 | 0.95 | KCNN4 (0.40) | CYP19A1KCNN4HDAC6HDAC3HDAC1 | |
| SCHEMBL11536641 | 0.85 | MAPK1 (0.39) | CYP19A1HDAC6HDAC3HDAC1HDAC2 | |
| SCHEMBL11535231 | 0.83 | KCNN4 (0.39) | CYP19A1KCNN4KIF11TDP1USP2 | |
| SCHEMBL11533304 | 0.80 | KIF11 (0.38) | KIF11TDP1KMT2AMAOB | |
| SCHEMBL11534894 | 0.80 | NPC1 (0.33) | CYP19A1KCNN4 | |
| SCHEMBL11554435 | 0.78 | DGAT1 (0.39) | CYP19A1KCNN4KMT2AMAP4K4 | |
| SCHEMBL11534919 | 0.76 | KMO (0.47) | CYP19A1KCNN4HDAC6HDAC3HDAC1 | |
| SCHEMBL11541379 | 0.76 | ALDH1A1 (0.48) | CYP19A1KIF11TDP1KMT2A | |
| SCHEMBL11535667 | 0.75 | KIF11 (0.40) | KIF11KMT2A | |
| SCHEMBL11535031 | 0.74 | KCNN4 (0.46) | CYP19A1KCNN4HDAC6HDAC3HDAC1 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4139625-A | 5-(Substituted triphenylmethyl)picolinamides and their use as anti-acne agents | SCHERING CORPORATION (US) | 1979-02-13 | — | — | US | disclosed |
| US-4133887-A | Trityl picolinic acid derivatives and their use as anti-acne agents | SCHERING CORPORATION (US) | 1979-01-09 | — | — | US | disclosed |
| US-4127662-A | ANTIACNE | SCHERING CORPORATION (US) | 1978-11-28 | — | — | US | disclosed |
| US-4123433-A | ANTIACNE AGENTS | SCHERING CORPORATION (US) | 1978-10-31 | — | — | US | disclosed |
| US-4044140-A | Trityl picolinic acid derivatives and their use as anti-acne agents | SCHERING CORPORATION (US) | 1977-08-23 | — | — | US | disclosed |