Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 2/20 | 0.55 |
| ▸ | CA2 | P00918 | 2/20 | 0.55 |
| ▸ | CA9 | Q16790 | 2/20 | 0.55 |
| ▸ | CA1 | P00915 | 1/20 | 0.55 |
| ▸ | CA7 | P43166 | 1/20 | 0.55 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.55 |
| ▸ | S100B | P04271 | 2/20 | 0.55 |
| ▸ | ACHE | P22303 | 2/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.52 |
| ▸ | NOS3 | P29474 | 2/20 | 0.50 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.50 |
| ▸ | HTR3B | O95264 | 1/20 | 0.50 |
| ▸ | HTR3A | P46098 | 1/20 | 0.50 |
| ▸ | HTR3D | Q70Z44 | 1/20 | 0.50 |
| ▸ | HTR3C | Q8WXA8 | 1/20 | 0.50 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.47 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | TP53 | P04637 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL12616347 | 1.00 | CA12 (0.55) | CA12CA2CA9CA1CA7 | |
| SCHEMBL12617752 | 1.00 | CA12 (0.55) | CA12CA2CA9CA1CA7 | |
| SCHEMBL14382844 | 0.91 | ACHE (0.62) | CA12CA2CA9CA1CA7 | |
| SCHEMBL14459430 | 0.87 | S100B (0.49) | CA12CA2CA9CA1CA7 | |
| SCHEMBL14459258 | 0.87 | S100B (0.49) | CA12CA2CA9CA1CA7 | |
| SCHEMBL6858465 | 0.85 | S100B (0.47) | CA12CA2CA9CA1CA7 | |
| SCHEMBL22861516 | 0.85 | S100B (0.47) | CA12CA2CA9CA1CA7 | |
| SCHEMBL22549462 | 0.83 | S100B (0.50) | CA12CA2CA9CA1CA7 | |
| SCHEMBL12432939 | 0.83 | NOS3 (0.50) | CA12CA2CA9CA1CA7 | |
| SCHEMBL13302734 | 0.83 | S100B (0.53) | CA12CA2CA9CA1CA7 |
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 12 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0280373-B1 | PROCESS FOR THE DIMERIZATION OF OLEFINS | SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) | 1992-08-12 | — | — | EP | disclosed |
| EP-0206367-B1 | PROCESS FOR THE DIMERIZATION OF ETHYLENICALLY UNSATURATED COMPOUNDS | SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) | 1990-06-27 | — | — | EP | disclosed |
| US-4859646-A | Process for the dimerization of olefins | SHELL OIL COMPANY (US) | 1989-08-22 | — | — | US | disclosed |
| US-4806647-A | PALLADIUM(II) COMPOUND, CHELATE LIGAND, PROTONIC ACID AND SALT | SHELL OIL COMPANY (US) | 1989-02-21 | — | — | US | disclosed |
| EP-0170311-B1 | PROCESS FOR THE DIMERIZATION OF OLEFINS | SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) | 1989-02-01 | — | — | EP | disclosed |
| US-4692548-A | DIMERIZATION OF ETHYLENICALLY UNSATURATED COMPOUNDS | SHELL OIL COMPANY (US) | 1987-09-08 | — | — | US | disclosed |
| US-4634793-A | PALLADIUM CATALYST SYSTEM | SHELL OIL COMPANY (US) | 1987-01-06 | — | — | US | disclosed |
| EP-0206367-A2 | Process for the dimerization of ethylenically unsaturated compounds | SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) | 1986-12-30 | — | — | EP | disclosed |
| EP-0170311-A2 | Process for the dimerization of olefins | SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) | 1986-02-05 | — | — | EP | disclosed |
| US-4066609-A | GLASS FABRIC OR FIBER | CIBA-GEIGY CORPORATION (US) | 1978-01-03 | — | — | US | disclosed |
| US-3993630-A | Polyimide, polyamide-imide or polyamide-acids with olefin end groups in combination with a reactive Schiff base compound | CIBA-GEIGY CORPORATION (US) | 1976-11-23 | — | — | US | disclosed |
| US-3944525-A | Crosslinked resins prepared from an N,N'-bis-imide and a schiff base | CIBA-GEIGY CORPORATION (US) | 1976-03-16 | — | — | US | disclosed |