Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.39 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.39 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.39 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.38 |
| ▸ | PYCR1 | P32322 | 3/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.35 |
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
| ▸ | USP2 | O75604 | 1/20 | 0.35 |
| ▸ | MAOA | P21397 | 1/20 | 0.35 |
| ▸ | MAOB | P27338 | 1/20 | 0.35 |
| ▸ | MMP3 | P08254 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | BLM | P54132 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | ATM | Q13315 | 1/20 | 0.33 |
| ▸ | LOXL2 | Q9Y4K0 | 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 | |
|---|---|---|---|---|
| SCHEMBL13001900 | 0.89 | ENPP2 (0.53) | MEN1KMT2ACYP1A2CYP1A1CYP1B1 | |
| SCHEMBL3689366 | 0.89 | ENPP2 (0.45) | ENPP2TSHR | |
| SCHEMBL26920214 | 0.89 | TSHR (0.42) | MEN1KMT2ACYP1A2CYP1A1CYP1B1 | |
| SCHEMBL10546841 | 0.87 | CALM1 (0.50) | CYP1A2PYCR1LMNACYP3A4TSHR | |
| SCHEMBL31135328 | 0.84 | PYCR1 (0.56) | CYP1A2PYCR1MAOAMAOBALDH1A1 | |
| SCHEMBL13892413 | 0.84 | IDO1 (0.48) | CYP1A2ENPP2PYCR1LMNASMN1; SMN2 | |
| SCHEMBL4769655 | 0.84 | PYCR1 (0.56) | CYP1A2PYCR1MAOAMAOBALDH1A1 | |
| SCHEMBL29413817 | 0.84 | TAAR1 (0.50) | MEN1KMT2AMAOB | |
| SCHEMBL5329712 | 0.84 | TAAR1 (0.50) | MEN1KMT2AMAOAMAOBALDH1A1 | |
| SCHEMBL7212246 | 0.84 | MAOB (0.52) | LMNACYP3A4MAOAMAOBALDH1A1 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0402975-B1 | Benzocyclobutene carboxylate esters | SHELL INT RESEARCH (NL) | 1994-08-10 | — | — | EP | disclosed |
| US-5142022-A | Thermosetting resin compositions comprising an unsaturated spirodilactam | SHELL OIL COMPANY (US) | 1992-08-25 | — | — | US | disclosed |
| EP-0402975-A2 | Benzocyclobutene carboxylate esters | SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) | 1990-12-19 | — | — | EP | disclosed |
| US-4954584-A | Thermosetting resin compositions | SHELL OIL COMPANY (US) | 1990-09-04 | — | — | US | disclosed |
| US-4927908-A | Curable resin composition comprising cyanato aryl spirodilactam | SHELL OIL COMPANY (US) | 1990-05-22 | — | — | US | disclosed |
| US-4921931-A | Thermosetting resin compositions | SHELL OIL COMPANY (US) | 1990-05-01 | — | — | US | disclosed |