Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 3/20 | 0.56 |
| ▸ | TSHR | P16473 | 2/20 | 0.56 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.56 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.47 |
| ▸ | HPGD | P15428 | 2/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.47 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.47 |
| ▸ | KIF11 | P52732 | 1/20 | 0.42 |
| ▸ | CFTR | P13569 | 1/20 | 0.42 |
| ▸ | GOPC | Q9HD26 | 1/20 | 0.42 |
| ▸ | ACP3 | P15309 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | PPARG | P37231 | 2/20 | 0.39 |
| ▸ | PPARA | Q07869 | 2/20 | 0.39 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.39 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.38 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL19130800 | 1.00 | CYP2C19 (0.56) | CYP2C19TSHRCYP3A4HSD17B10CYP1A2 | |
| SCHEMBL7120000 | 0.90 | CYP2C19 (0.47) | CYP2C19TSHRCYP3A4HSD17B10CYP1A2 | |
| SCHEMBL17111064 | 0.89 | CYP2C19 (0.44) | CYP2C19TSHRCYP3A4HSD17B10CYP1A2 | |
| SCHEMBL19130465 | 0.87 | TSHR (0.44) | CYP2C19TSHRCYP3A4HSD17B10CYP1A2 | |
| SCHEMBL19149263 | 0.83 | KMT2A (0.47) | CYP2C19TSHRCYP3A4HSD17B10CYP1A2 | |
| SCHEMBL17295935 | 0.83 | KMT2A (0.47) | CYP2C19TSHRCYP3A4HSD17B10CYP1A2 | |
| SCHEMBL10693897 | 0.82 | CYP3A4 (0.47) | CYP2C19TSHRCYP3A4CYP1A2CYP2C9 | |
| SCHEMBL2355481 | 0.80 | CYP1A2 (0.59) | CYP2C19TSHRCYP3A4HSD17B10CYP1A2 | |
| SCHEMBL3003485 | 0.80 | CYP3A4 (0.42) | CYP2C19TSHRCYP3A4HSD17B10CYP1A2 | |
| SCHEMBL5013862 | 0.80 | TSHR (0.42) | CYP2C19TSHRCYP3A4HSD17B10CYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| US-10196338-B2 | Chiral diamine compounds for the preparation of chiral alcohols and chiral amines | UNIVERSITY COLLEGE DUBLIN (IE) | 2019-02-05 | — | — | US | disclosed |
| US-10196338-B2 | Chiral diamine compounds for the preparation of chiral alcohols and chiral amines | UNIVERSITY COLLEGE DUBLIN (IE) | 2019-02-05 | — | — | US | disclosed |
| US-20170204036-A1 | CHIRAL DIAMINE COMPOUNDS FOR THE PREPARATION OF CHIRAL ALCOHOLS AND CHIRAL AMINES | UNIVERSITY COLLEGE DUBLIN (IE) | 2017-07-20 | — | — | US | disclosed |
| EP-3148978-A1 | CHIRAL DIAMINE COMPOUNDS FOR THE PREPARATION OF CHIRAL ALCOHOL AND CHIRAL AMINE | UNIVERSITY COLLEGE DUBLIN (IE) | 2017-04-05 | — | — | EP | disclosed |
| WO-2015181182-A1 | CHIRAL DIAMINE COMPOUNDS FOR THE PREPARATION OF CHIRAL ALCOHOL AND CHIRAL AMINE | UNIVERSITY COLLEGE DUBLIN (IE) | 2015-12-03 | — | — | WO | disclosed |
| US-4994539-A | Ethylene-unsaturated aromatic copolymer | NIPPON PETROCHEMICALS CO., LTD. (JP) | 1991-02-19 | — | — | US | disclosed |
| EP-0180771-B1 | METHOD FOR IMPROVING IMPULSE BREAKDOWN STRENGTH OF ELECTRICALLY INSULATING MATERIALS | Nippon Petrochemicals Co., Ltd. (JP) | 1989-08-02 | — | — | EP | disclosed |
| US-4734824-A | MONOOLEFIN OR DIOLEFIN HAVING THREE CONDENSED OR NONCONDENSED AROMATIC RINGS | NIPPON PETROCHEMICALS COMPANY, LIMITED (JP) | 1988-03-29 | — | — | US | disclosed |
| EP-0154993-B1 | ELECTRICAL INSULATING OIL AND ELECTRICAL APPLIANCES IMPREGNATED WITH THE SAME | NIPPON PETROCHEMICALS COMPANY, LIMITED (JP) | 1988-03-09 | — | — | EP | disclosed |
| US-4621302-A | MONO-OR DIOLEFIN HAVING THREE CONDENSED OR NON-CONDENSED AROMATIC RINGS | NIPPON PETROCHEMICALS COMPANY, LIMITED (JP) | 1986-11-04 | — | — | US | disclosed |
| EP-0180771-A1 | Method for improving impulse breakdown strength of electrically insulating materials | Nippon Petrochemicals Co., Ltd. (JP) | 1986-05-14 | — | — | EP | disclosed |
| EP-0154993-A1 | Electrical insulating oil and electrical appliances impregnated with the same | NIPPON PETROCHEMICALS COMPANY, LIMITED (JP) | 1985-09-18 | — | — | EP | disclosed |
Patent text — is the patent's own abstract consistent with the prediction?
For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.
| Patent | Title | Text reads most about | Predicted target · text-rank |
|---|---|---|---|
| US-10196338-B2 | Chiral diamine compounds for the preparation of chiral alcohols and chiral amines | ADH1C, ADH1A, ADH5 | CYP2C19 1200/4885TSHR 740/4885CYP3A4 433/4885 |
| US-20170204036-A1 | CHIRAL DIAMINE COMPOUNDS FOR THE PREPARATION OF CHIRAL ALCOHOLS AND CHIRAL AMINES | ADH1C, ADH1A, ADH5 | CYP2C19 1275/4885TSHR 614/4885CYP3A4 363/4885 |
“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.