Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 2/20 | 0.42 |
| ▸ | CA2 | P00918 | 2/20 | 0.42 |
| ▸ | CA4 | P22748 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | CA12 | O43570 | 1/20 | 0.36 |
| ▸ | CA9 | Q16790 | 1/20 | 0.36 |
| ▸ | CCR2 | P41597 | 1/20 | 0.34 |
| ▸ | ACHE | P22303 | 1/20 | 0.33 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL24820171 | 0.94 | HTT (0.37) | CA1CA2CA4KMT2AACHE | |
| SCHEMBL9810899 | 0.89 | CA1 (0.39) | CA1CA2CA4KMT2ACA12 | |
| SCHEMBL1460586 | 0.87 | S1PR1 (0.40) | CA1CA2CA4CCR2EPHX1 | |
| SCHEMBL17591686 | 0.86 | S1PR1 (0.42) | CCR2EPHX1 | |
| SCHEMBL1664270 | 0.84 | NAAA (0.44) | EPHX1 | |
| SCHEMBL21710335 | 0.80 | CA1 (0.38) | CA1CA2CA4KMT2ACA12 | |
| SCHEMBL22563652 | 0.78 | — | — | |
| SCHEMBL19306981 | 0.77 | CCR2 (0.45) | CCR2 | |
| SCHEMBL10916213 | 0.73 | CCR2 (0.57) | CCR2HTT | |
| SCHEMBL10698474 | 0.73 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1542981-A1 | PROCESS FOR THE PREPARATION OF 2-AMINO-4,5,6,7-TETRAHYDRO-6-AMINOBENZOTHIAOLES FROM CYCLOHEXANES AND CYCLOHEXANONES AS INTERMEDIATES | Generics (UK) Limited (GB) | 2005-06-22 | — | — | EP | disclosed |
| WO-2004026850-A1 | PROCESS FOR THE PREPARATION OF 2-AMINO-4,5,6,7-TETRAHYDRO-6-AMINOBENZOTHIAOLES FROM CYCLOHEXANES AND CYCLOHEXANONES AS INTERMEDIATES | GENERICS [UK] LIMITED (GB) | 2004-04-01 | — | — | WO | disclosed |
| EP-0001594-B1 | PROCESS FOR PREPARATION OF DIOXIMINO-CYCLOHEXANES | BASF Aktiengesellschaft (DE) | 1981-09-02 | — | — | EP | disclosed |
| EP-0001594-A2 | Process for preparation of Dioximino-cyclohexanes | BASF Aktiengesellschaft (DE) | 1979-05-02 | — | — | EP | disclosed |