Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 10/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 9/20 | 0.49 |
| ▸ | RAB9A | P51151 | 8/20 | 0.49 |
| ▸ | NPC1 | O15118 | 7/20 | 0.49 |
| ▸ | HPGD | P15428 | 7/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 6/20 | 0.49 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.49 |
| ▸ | TP53 | P04637 | 1/20 | 0.45 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.45 |
| ▸ | GAA | P10253 | 2/20 | 0.43 |
| ▸ | LTA4H | P09960 | 1/20 | 0.43 |
| ▸ | GFER | P55789 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 3/20 | 0.42 |
| ▸ | POLB | P06746 | 2/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| Isoxazole SCHEMBL27894024 | 0.88 | RAB9A (0.41) | ALDH1A1KDM4ERAB9ANPC1HPGD | |
| SCHEMBL28928822 | 0.84 | SMN1; SMN2 (0.42) | ALDH1A1KDM4ERAB9ANPC1HPGD | |
| SCHEMBL3220235 | 0.78 | RAB9A (0.39) | ALDH1A1KDM4ERAB9ANPC1HPGD | |
| SCHEMBL5132723 | 0.72 | ALDH1A1 (0.49) | ALDH1A1KDM4ERAB9ANPC1HPGD | |
| SCHEMBL13762461 | 0.70 | KDM4E (0.70) | ALDH1A1KDM4ERAB9ANPC1HPGD | |
| SCHEMBL100765 | 0.69 | HPGDS (0.46) | LTA4HHPGDS | |
| SCHEMBL9065298 | 0.69 | HPGDS (0.42) | LTA4HCYP1A2CYP2D6CYP3A4HPGDS | |
| SCHEMBL22698306 | 0.68 | LTA4H (0.40) | LTA4HMAPTHPGDSHDAC8 | |
| SCHEMBL262283 | 0.68 | RAB9A (0.45) | ALDH1A1KDM4ERAB9ANPC1HPGD | |
| SCHEMBL262142 | 0.68 | KDM4E (0.49) | ALDH1A1KDM4ERAB9ANPC1HPGD |
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
Appears in 10203 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-4337220-A1 | SELECTIVE, PARTIAL, AND ARRESTIN-BIASED 5-HT2A AGONISTS WITH UTILITY IN VARIOUS DISORDERS | Saint Joseph's University (US) | 2024-03-20 | — | — | EP | claimed |
| CN-116003433-A | Organic photosensitive molecule with spectral response reaching infrared region and application thereof | 广州光达创新科技有限公司 | 2023-04-25 | — | — | CN | claimed |
| US-20220396571-A1 | SPIROPIPERIDINE ALLOSTERIC MODULATORS OF NICOTINIC ACETYLCHOLINE RECEPTORS | MERCK SHARP & DOHME CORP. (US) | 2022-12-15 | — | — | US | claimed |
| CN-114891027-A | Infrared-response N-type organic molecule and application thereof | 广州光达创新科技有限公司 | 2022-08-12 | — | — | CN | claimed |
| CN-113683616-A | KRAS G12C mutein inhibitors | 广州百霆医药科技有限公司 | 2021-11-23 | — | — | CN | claimed |
| CN-113527300-A | Bruton's tyrosine protein kinase inhibitor | 广州百霆医药科技有限公司 | 2021-10-22 | — | — | CN | claimed |
| EP-3253764-B1 | MACROCYCLIC COMPOUNDS AS IRAK1/4 INHIBITORS AND USES THEREOF | MERCK PATENT GMBH (DE) | 2021-06-09 | — | — | EP | claimed |
| US-10870630-B2 | Substituted bicyclic heteroaryl allosteric modulators of nicotinic acetylcholine receptors | MERCK SHARP & DOHME CORP. | 2020-12-22 | — | — | US | claimed |
| EP-3253763-B1 | PYRIDAZINONE MACROCYCLES AS IRAK INHIBITORS AND USES THEREOF | MERCK PATENT GMBH (DE) | 2020-09-30 | — | — | EP | claimed |
| US-20200246274-A1 | GLUTAMINASE INHIBITOR DISCOVERY AND NANOPARTICLE-ENHANCED DELIVERY FOR CANCER THERAPY | THE JOHNS HOPKINS UNIVERSITY | 2020-08-06 | — | — | US | claimed |
| US-6124302-A | TREATING HIV INFECTIONS | DUPONT PHARMACEUTICALS (US) | 2000-09-26 | — | — | US | claimed |
| WO-2000047553-A2 | ALKENYL AND ALKYNYL COMPOUNDS AS INHIBITORS OF FACTOR Xa | COR THERAPEUTICS INC. (US) | 2000-08-17 | — | — | WO | claimed |
| CN-1261345-A | Glyoxylic acid amides | BAYER AG (DE) | 2000-07-26 | — | — | CN | claimed |
| CN-1216043-A | Substd. benzenesulfonamide derivs as prodrugs of COX-2 inhibitors | SEARLE & CO (US) | 1999-05-05 | — | — | CN | claimed |
| CN-1095591-A | The associating of a kind of cholesteral biosynthesis inhibitor and a kind of beta-lactam cholesterol absorption inhibitor | SCHERING CORP (US) | 1994-11-30 | — | — | CN | claimed |
| CN-1069024-A | As 'beta '-lactam compounds that reduces the replacement of cholesterol medicament in the blood and preparation method thereof | SCHERING CORP (US) | 1993-02-17 | — | — | CN | claimed |
| EP-0170498-B1 | N-ACETONYL-SUBSTITUTED-AMIDES, COMPOSITIONS CONTAINING THEM AND THEIR USE IN COMBATING FUNGI | ROHM AND HAAS COMPANY (US) | 1991-09-11 | — | — | EP | claimed |
| US-4980348-A | HETEROANELLATED PHENYLGLYCINE-BETA-LACTAM ANTIBIOTICS | BAYER AKTIENGESELLSCHAFT (DE) | 1990-12-25 | — | — | US | claimed |
| CN-88103202-A | Vinyl cephalosporin compound that replaces and preparation method thereof and as the application of medicine | — | 1988-12-21 | — | — | CN | claimed |
| US-4147789-A | ANTIPARKINSON AGENTS | SANDOZ LTD. (CH) | 1979-04-03 | — | — | US | claimed |