Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.45 |
| ▸ | HTR2A | P28223 | 1/20 | 0.45 |
| ▸ | HTR2C | P28335 | 1/20 | 0.45 |
| ▸ | HTR2B | P41595 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 4/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | SLC6A2 | P23975 | 3/20 | 0.44 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.44 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | HPGD | P15428 | 2/20 | 0.42 |
| ▸ | SCN4A | P35499 | 2/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL10720954 | 0.90 | ESR2 (0.42) | TSHRHTR2AHTR2CHTR2BMEN1 | |
| SCHEMBL11084242 | 0.80 | TSHR (0.49) | TSHRHTR2AHTR2CHTR2BMEN1 | |
| SCHEMBL8985167 | 0.79 | GAA (0.44) | TSHRMEN1KMT2AMAPTCYP3A4 | |
| SCHEMBL11033634 | 0.79 | ALDH1A1 (0.38) | TSHRMEN1KMT2AMAPTCYP1A2 | |
| SCHEMBL29489134 | 0.79 | GAA (0.44) | TSHRMEN1KMT2AMAPTCYP3A4 | |
| SCHEMBL9351955 | 0.79 | SLC6A3 (0.47) | TSHRMAPTSLC6A2SLC6A4SLC6A3 | |
| SCHEMBL9348273 | 0.78 | SLC6A4 (0.48) | MEN1KMT2ASLC6A2SLC6A4SLC6A3 | |
| SCHEMBL11338994 | 0.78 | AR (0.34) | HTR2AMAPTSLC6A4GAA | |
| SCHEMBL807773 | 0.76 | SLC6A2 (0.59) | TSHRHTR2AHTR2CHTR2BMEN1 | |
| SCHEMBL9419423 | 0.76 | ALDH1A1 (0.39) | TSHRMEN1KMT2AKDM4EALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0271833-B1 | Process for the preparation of aminopyrimidines | HOECHST SCHERING AGREVO GMBH (DE) | 1994-09-07 | — | — | EP | disclosed |
| EP-0245901-B1 | THIAZINONE DERIVATIVES | SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) | 1992-08-26 | — | — | EP | disclosed |
| US-4839356-A | FUNGICIDES FOR PLANTS | SHELL INTERNATIONALE RESEARCH MAATSCHAPPIJ B.V. (NL) | 1989-06-13 | — | — | US | disclosed |
| US-4833137-A | FUNGICIDES FOR PLANTS | SHELL INTERNATIONALE RESEARCH MAATSCHAPPIJ B.V. (NL) | 1989-05-23 | — | — | US | disclosed |
| US-4831138-A | FROM PROPANEDIIMIDATES DERIVATIVES AND CYANURATES | HOECHST AKTIENGESELLSCHAFT (DE) | 1989-05-16 | — | — | US | disclosed |
| EP-0271833-A2 | Process for the preparation of aminopyrimidines | Hoechst Schering AgrEvo GmbH (DE) | 1988-06-22 | — | — | EP | disclosed |
| EP-0245901-A2 | Thiazinone derivatives | SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) | 1987-11-19 | — | — | EP | disclosed |