Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 1/20 | 0.69 |
| ▸ | PTGS2 | P35354 | 4/20 | 0.46 |
| ▸ | PTGES2 | Q9H7Z7 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 4/20 | 0.41 |
| ▸ | PKM | P14618 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | HTT | P42858 | 2/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 3/20 | 0.39 |
| ▸ | CA1 | P00915 | 2/20 | 0.39 |
| ▸ | MMP1 | P03956 | 1/20 | 0.39 |
| ▸ | MMP2 | P08253 | 1/20 | 0.39 |
| ▸ | MMP9 | P14780 | 1/20 | 0.39 |
| ▸ | MMP8 | P22894 | 1/20 | 0.39 |
| ▸ | MMP13 | P45452 | 1/20 | 0.39 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.39 |
| ▸ | F2RL3 | Q96RI0 | 2/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL30943226 | 1.00 | CYP19A1 (0.69) | CYP19A1PTGS2PTGES2MAPTPKM | |
| SCHEMBL2420496 | 0.82 | CYP19A1 (1.00) | CYP19A1MAPTPKMKMT2AHTT | |
| SCHEMBL17199187 | 0.81 | CYP19A1 (0.74) | CYP19A1MAPTKMT2AHTTL3MBTL1 | |
| SCHEMBL23320529 | 0.81 | CYP19A1 (0.74) | CYP19A1MAPTKMT2AHTTL3MBTL1 | |
| SCHEMBL30943232 | 0.81 | CYP19A1 (0.74) | CYP19A1MAPTKMT2AHTTL3MBTL1 | |
| SCHEMBL30943322 | 0.80 | PTGES2 (0.47) | CYP19A1PTGS2PTGES2KMT2AGRM2 | |
| SCHEMBL23320518 | 0.80 | PTGES2 (0.47) | CYP19A1PTGS2PTGES2KMT2AGRM2 | |
| SCHEMBL11763677 | 0.80 | CYP19A1 (0.70) | CYP19A1MAPTKMT2AHTTL3MBTL1 | |
| SCHEMBL17199054 | 0.75 | CYP19A1 (0.75) | CYP19A1PTGS2MAPTPKMKMT2A | |
| SCHEMBL17199051 | 0.75 | CYP19A1 (0.75) | CYP19A1MAPTPKMKMT2ALMNA |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112654608-B | Fused ring compound having urea structure | 桑福德伯纳姆普利斯医学发现研究所 | 2024-05-07 | — | — | CN | disclosed |
| EP-3818053-A1 | FUSED RING COMPOUND HAVING UREA STRUCTURE | Sanford Burnham Prebys Medical Discovery Institute (US) | 2021-05-12 | — | — | EP | disclosed |
| CN-112654608-A | Condensed ring compounds having urea structure | 桑福德伯纳姆普利斯医学发现研究所 | 2021-04-13 | — | — | CN | disclosed |