Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES1 | P23141 | 2/20 | 0.56 |
| ▸ | MEN1 | O00255 | 3/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.48 |
| ▸ | POLB | P06746 | 2/20 | 0.48 |
| ▸ | S100A4 | P26447 | 2/20 | 0.48 |
| ▸ | CASP3 | P42574 | 2/20 | 0.46 |
| ▸ | CDC25B | P30305 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | EHMT2 | Q96KQ7 | 1/20 | 0.44 |
| ▸ | EHMT1 | Q9H9B1 | 1/20 | 0.44 |
| ▸ | IDO1 | P14902 | 1/20 | 0.43 |
| ▸ | DNMT1 | P26358 | 1/20 | 0.43 |
| ▸ | DNMT3L | Q9UJW3 | 1/20 | 0.43 |
| ▸ | DNMT3A | Q9Y6K1 | 1/20 | 0.43 |
| ▸ | CA12 | O43570 | 1/20 | 0.43 |
| ▸ | CA9 | Q16790 | 1/20 | 0.43 |
| ▸ | GLS | O94925 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | CES2 | O00748 | 1/20 | 0.43 |
| ▸ | APAF1 | O14727 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL135882 | 1.00 | CES1 (0.56) | CES1MEN1KMT2APOLBS100A4 | |
| SCHEMBL29172805 | 0.97 | CES1 (0.54) | CES1MEN1KMT2APOLBS100A4 | |
| SCHEMBL6135716 | 0.88 | CES1 (0.47) | CES1MEN1KMT2APOLBS100A4 | |
| Acetonitrile SCHEMBL29009230 | 0.86 | CES1 (0.45) | CES1MEN1KMT2APOLBS100A4 | |
| Acetic Acid SCHEMBL7085107 | 0.86 | LMNA (0.50) | CES1MEN1KMT2APOLBCASP3 | |
| SCHEMBL8045796 | 0.83 | CES1 (0.47) | CES1MEN1KMT2APOLBS100A4 | |
| SCHEMBL10724958 | 0.83 | CES1 (0.47) | CES1MEN1KMT2APOLBS100A4 | |
| SCHEMBL8407065 | 0.78 | ERCC1 (0.63) | CES1MEN1KMT2ACYP1A2KDM4E | |
| SCHEMBL454827 | 0.75 | POLB (0.67) | CES1MEN1KMT2APOLBS100A4 | |
| SCHEMBL11214758 | 0.74 | HSPA1A (0.55) | MEN1KMT2APOLBKDM4ENPC1 |
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 13 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117500778-A | 2-substituted bicyclo [1.1.1] pentanes | 普林斯顿大学保管委员会 | 2024-02-02 | — | — | CN | claimed |
| WO-2025078335-A1 | PROCESSES FOR THE PREPARATION OF DEUCRAVACITINIB | FARMHISPANIA GROUP, S.L. (ES) | 2025-04-17 | — | — | WO | disclosed |
| WO-2024142096-A1 | PROCESS FOR PREPARATION OF NIRAPARIB TOSYLATE AND ITS INTERMEDIATES | DR. REDDY’S LABORATORIES LIMITED (IN) | 2024-07-04 | — | — | WO | disclosed |
| EP-4330228-A1 | G-ALPHA-S INHIBITORS AND USES THEREOF | The Regents of the University of California (US) | 2024-03-06 | — | — | EP | disclosed |
| CN-117500778-A | 2-substituted bicyclo [1.1.1] pentanes | 普林斯顿大学保管委员会 | 2024-02-02 | — | — | CN | disclosed |
| EP-4294784-A1 | 2-SUBSTITUTED BICYCLO[1.1.1]PENTANES | The Trustees of Princeton University (US) | 2023-12-27 | — | — | EP | disclosed |
| EP-4247783-A1 | PROCESSES AND INTERMEDIATES FOR PREPARING MACROCYCLIC MCL1 INHIBITORS | GILEAD SCIENCES, INC. (US) | 2023-09-27 | — | — | EP | disclosed |
| CN-115557823-A | Method for synthesizing amide compound | 浙江工业大学 | 2023-01-03 | — | — | CN | disclosed |
| WO-2022232142-A1 | G-ALPHA-S INHIBITORS AND USES THEREOF | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 2022-11-03 | — | — | WO | disclosed |
| WO-2022191254-A1 | HALOETHER, METHOD FOR PRODUCING SAME, VINYL ETHER, AND METHOD FOR PRODUCING SAME | ダイキン工業株式会社 | 2022-09-15 | — | — | WO | disclosed |
| WO-2022178559-A1 | 2-SUBSTITUTED BICYCLO[1.1.1]PENTANES | THE TRUSTEES OF PRINCETON UNIVERSITY (US) | 2022-08-25 | — | — | WO | disclosed |
| WO-2022108984-A1 | PROCESSES AND INTERMEDIATES FOR PREPARING MACROCYCLIC MCL1 INHIBITORS | GILEAD SCIENCES, INC. (US) | 2022-05-27 | — | — | WO | disclosed |
| CN-112279802-B | Preparation method of 2-chloromethyl-3-trifluoromethylpyridine | 江苏美迪克化学品有限公司 | 2022-03-08 | — | — | CN | disclosed |