Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | TSHR | P16473 | 2/20 | 0.40 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.37 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.37 |
| ▸ | ACHE | P22303 | 2/20 | 0.36 |
| ▸ | SELL | P14151 | 1/20 | 0.36 |
| ▸ | SELP | P16109 | 1/20 | 0.36 |
| ▸ | SELE | P16581 | 1/20 | 0.36 |
| ▸ | HDAC8 | Q9BY41 | 5/20 | 0.36 |
| ▸ | CA12 | O43570 | 2/20 | 0.32 |
| ▸ | CA1 | P00915 | 2/20 | 0.32 |
| ▸ | CA2 | P00918 | 2/20 | 0.32 |
| ▸ | CA9 | Q16790 | 2/20 | 0.32 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.32 |
| ▸ | CA4 | P22748 | 1/20 | 0.32 |
| ▸ | TPMT | P51580 | 1/20 | 0.32 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.31 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.31 |
| ▸ | C1S | P09871 | 1/20 | 0.31 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL29287702 | 0.87 | ALDH1A1 (0.57) | ALDH1A1TSHRCYP1A1CYP1B1ACHE | |
| SCHEMBL26377782 | 0.82 | ACHE (0.36) | CYP1A1CYP1B1ACHEHDAC8 | |
| SCHEMBL18934332 | 0.82 | ALDH1A1 (0.42) | ALDH1A1CYP1A1CYP1B1 | |
| SCHEMBL7039619 | 0.82 | ALDH1A1 (0.55) | ALDH1A1TSHRCYP1A1CYP1B1ACHE | |
| SCHEMBL13982141 | 0.82 | RAPGEF4 (0.33) | TSHRCYP1A1CYP1B1HDAC8 | |
| SCHEMBL17552583 | 0.78 | ALDH1A1 (0.42) | ALDH1A1TSHRCYP1A1CYP1B1ACHE | |
| SCHEMBL20633339 | 0.77 | IDO1 (0.38) | — | |
| SCHEMBL211753 | 0.75 | CYP1A1 (0.46) | CYP1A1CYP1B1HDAC8CA12CA1 | |
| SCHEMBL23235858 | 0.75 | GRM5 (0.32) | — | |
| SCHEMBL13671476 | 0.75 | TPMT (0.61) | ALDH1A1TSHRSELLSELPCA12 |
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 36 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-113735672-A | Preparation method of fully-substituted 1-butene-3-alkyne derivative | 昆明理工大学 | 2021-12-03 | — | — | CN | claimed |
| CN-111533684-B | Method for alkenylating pyridine compound | 四川大学 | 2021-10-29 | — | — | CN | claimed |
| CN-111808071-A | Method for synthesizing polysubstituted aminoisoquinoline compound by cyclization of pyridine and alkyne under catalysis of rhodium | 中国科学院兰州化学物理研究所 | 2020-10-23 | — | — | CN | claimed |
| CN-111533684-A | Method for alkenylating pyridine compound | 四川大学 | 2020-08-14 | — | — | CN | claimed |
| CN-118324603-A | Method for synthesizing chrysene derivatives through palladium-catalyzed cycloaromatization reaction | 湖南师范大学 | 2024-07-12 | — | — | CN | disclosed |
| CN-114409669-B | C-5 alkynyl substituted cantharidin derivative on oxanorbornene ring and preparation method and application thereof | 云南民族大学 | 2023-06-23 | — | — | CN | disclosed |
| CN-111233827-B | 2,5-disubstituted selenophene compound and synthetic method thereof | 华南理工大学 | 2022-10-25 | — | — | CN | disclosed |
| US-11345665-B2 | Chiral 1,3-diarylimidazolium salt carbene precursor, synthesis method therefor, metal salt compound and application thereof | SHANGHAI INSTITUTE OF ORGANIC CHEMISTRY, CHINESE ACADEMY OF SCIENCES (CN) | 2022-05-31 | — | — | US | disclosed |
| CN-114409669-A | C-5 alkynyl substituted cantharidin derivative on oxanorbornene ring and preparation method and application thereof | 云南民族大学 | 2022-04-29 | — | — | CN | disclosed |
| CN-111808071-B | Method for synthesizing polysubstituted aminoisoquinoline compound by cyclization of pyridine and alkyne under catalysis of rhodium | 中国科学院兰州化学物理研究所 | 2022-03-25 | — | — | CN | disclosed |
| CN-109776422-B | Chiral 1, 3-diaryl imidazole salt carbene precursor, synthesis method thereof, metal salt compound and application | 中国科学院上海有机化学研究所 | 2022-01-14 | — | — | CN | disclosed |
| CN-113735672-A | Preparation method of fully-substituted 1-butene-3-alkyne derivative | 昆明理工大学 | 2021-12-03 | — | — | CN | disclosed |
| EP-0868178-A1 | ANTAGONISTS OF GONADOTROPIN RELEASING HORMONE | Merck & Co., Inc. (US) | 1998-10-07 | — | — | EP | disclosed |
| US-5756507-A | TREATING SEX HORMONE RELATED DISORDERS | MERCK & CO., INC. (US) | 1998-05-26 | — | — | US | disclosed |
| WO-1997021435-A1 | ANTAGONISTS OF GONADOTROPIN RELEASING HORMONE | MERCK & CO., INC. (US) | 1997-06-19 | — | — | WO | disclosed |
| EP-0410361-B1 | Process for producing styrene polymers | IDEMITSU KOSAN CO (JP) | 1996-02-28 | — | — | EP | disclosed |
| EP-0662465-A1 | A purifying method of a styrene monomer | IDEMITSU KOSAN COMPANY LIMITED (JP) | 1995-07-12 | — | — | EP | disclosed |
| EP-0410361-A2 | Process for producing styrene polymers | IDEMITSU KOSAN COMPANY LIMITED (JP) | 1991-01-30 | — | — | EP | disclosed |
| US-4024273-A | Coronary vasodilator and anti-anginal compositions comprising substituted benzofurans and benzothiophenes and methods of producing coronary vasodilation and anti-anginal activity | SMITHKLINE CORPORATION (US) | 1977-05-17 | — | — | US | disclosed |
| US-3947470-A | CORONARY VASODILATORS, TREATMENT OF ANGINA PECTORIS | SMITHKLINE CORPORATION (US) | 1976-03-30 | — | — | US | 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 (1 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-11345665-B2 | Chiral 1,3-diarylimidazolium salt carbene precursor, synthesis method therefor, metal salt compound and application thereof | CYP51A1, SLC39A11, ZC3HAV1L | ALDH1A1 777/4885TSHR 4702/4885CYP1A1 156/4885 |
“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.