Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.65 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.62 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.55 |
| ▸ | MEN1 | O00255 | 3/20 | 0.55 |
| ▸ | MAPT | P10636 | 2/20 | 0.55 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.50 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.47 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.47 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.47 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | HPGD | P15428 | 1/20 | 0.47 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 2/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | MARS2 | Q96GW9 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL9297310 | 1.00 | NPC1 (0.65) | NPC1ALDH1A1KMT2AMEN1MAPT | |
| SCHEMBL9297312 | 1.00 | NPC1 (0.65) | NPC1ALDH1A1KMT2AMEN1MAPT | |
| SCHEMBL30681736 | 0.89 | ALDH1A1 (0.57) | NPC1ALDH1A1KMT2AMEN1MAPT | |
| SCHEMBL12814969 | 0.84 | ALDH1A1 (0.64) | NPC1ALDH1A1KMT2AMEN1MAPT | |
| SCHEMBL8044437 | 0.83 | ALDH1A1 (0.58) | NPC1ALDH1A1KMT2AMEN1MAPT | |
| SCHEMBL22076568 | 0.82 | NPC1 (0.60) | NPC1ALDH1A1KMT2AMEN1MAPT | |
| SCHEMBL7945836 | 0.81 | KMT2A (0.52) | NPC1ALDH1A1KMT2AMEN1MAPT | |
| SCHEMBL9319278 | 0.81 | KMT2A (0.52) | NPC1ALDH1A1KMT2AMEN1MAPT | |
| SCHEMBL9319273 | 0.81 | KMT2A (0.52) | NPC1ALDH1A1KMT2AMEN1MAPT | |
| SCHEMBL27573412 | 0.81 | KMT2A (0.60) | ALDH1A1KMT2AMEN1HPGDLMNA |
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 47 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117326950-A | Method for synthesizing (4R) -4- (4' -nitrophenyl) -4-hydroxy-2-butanone based on molecular printing technology | 重庆大学 | 2024-01-02 | — | — | CN | claimed |
| CN-117046516-A | Method for catalyzing asymmetric aldol reaction by paranitrobenzaldehyde and acetone by chiral catalyst | 南京工业大学 | 2023-11-14 | — | — | CN | claimed |
| CN-120132903-A | Solid-supported organic base catalyst and preparation method and application thereof | 清华大学 | 2025-06-13 | — | — | CN | disclosed |
| CN-117326950-A | Method for synthesizing (4R) -4- (4' -nitrophenyl) -4-hydroxy-2-butanone based on molecular printing technology | 重庆大学 | 2024-01-02 | — | — | CN | disclosed |
| CN-117326950-A | Method for synthesizing (4R) -4- (4' -nitrophenyl) -4-hydroxy-2-butanone based on molecular printing technology | 重庆大学 | 2024-01-02 | — | — | CN | disclosed |
| CN-117326950-A | Method for synthesizing (4R) -4- (4' -nitrophenyl) -4-hydroxy-2-butanone based on molecular printing technology | 重庆大学 | 2024-01-02 | — | — | CN | disclosed |
| CN-117046516-A | Method for catalyzing asymmetric aldol reaction by paranitrobenzaldehyde and acetone by chiral catalyst | 南京工业大学 | 2023-11-14 | — | — | CN | disclosed |
| CN-112266327-B | Method for synthesizing beta-hydroxycarbonyl compound by catalyzing asymmetric Aldol reaction in aqueous phase | 昆明理工大学（CN） | 2023-01-13 | — | — | CN | disclosed |
| CN-112266327-A | Method for synthesizing beta-hydroxycarbonyl compound by catalyzing asymmetric Aldol reaction in aqueous phase | 昆明理工大学 | 2021-01-26 | — | — | CN | disclosed |
| CN-109776371-B | Chiral tridentate ligand of nitrogen-containing heterocyclic propane and preparation method thereof | 北京化工大学 | 2020-12-25 | — | — | CN | disclosed |
| US-8399684-B2 | Sulfonamide-based organocatalysts and method for their use | STATE OF OREGON ACTING BY AND THROUGH THE STATE BOARD OF HIGHER EDUCATION ON BEHALF OF OREGON STATE UNIVERSITY (US) | 2013-03-19 | — | — | US | disclosed |
| US-6326176-B1 | ALDOL CONDENSATIONS AND CATALYTIC ANTIBODIES | THE SCRIPPS RESEARCH INSTITUTE | 2001-12-04 | — | — | US | disclosed |
| EP-1038018-A1 | ALDOL CONDENSATIONS BY CATALYTIC ANTIBODIES | The Scripps Research Institute (US) | 2000-09-27 | — | — | EP | disclosed |
| WO-1999031263-A1 | ALDOL CONDENSATIONS BY CATALYTIC ANTIBODIES | THE SCRIPPS RESEARCH INSTITUTE (US) | 1999-06-24 | — | — | WO | disclosed |
| US-5314817-A | Hapten modified with pyrimidine dimer or benzylammonium group, useful in reactions of proteins, nucleic acids and carbohydrates | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 1994-05-24 | — | — | US | disclosed |
| US-5302516-A | Polypeptides having a binding site specific for a reactant and having an active functionality near that site to promote or catalyze the reaction; kinetics | REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 1994-04-12 | — | — | US | disclosed |
| US-5215889-A | CATALYTIC AND REACTIVE POLYPEPTIDES AND METHODS FOR THEIR PREPARATION AND USE | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 1993-06-01 | — | — | US | disclosed |
| EP-0445214-A4 | CATALYTIC AND REACTIVE POLYPEPTIDES AND METHODS FOR THEIR PREPARATION AND USE | — | 1991-11-13 | — | — | EP | disclosed |
| EP-0445214-A1 | CATALYTIC AND REACTIVE ANTIBODIES AND ANTIBODY FRAGMENTS AND METHODS FOR THEIR PREPARATION AND USE | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 1991-09-11 | — | — | EP | disclosed |
| WO-1990005746-A1 | CATALYTIC AND REACTIVE POLYPEPTIDES AND METHODS FOR THEIR PREPARATION AND USE | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 1990-05-31 | — | — | WO | disclosed |