⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.
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 | |
|---|---|---|---|---|
| SCHEMBL1747877 | 0.77 | CYP2A13 (0.30) | — | |
| Hydrochloric Acid SCHEMBL1761554 | 0.75 | — | — | |
| SCHEMBL678774 | 0.59 | — | — | |
| SCHEMBL7422557 | 0.57 | CYP2C9 (0.36) | — | |
| SCHEMBL21769106 | 0.57 | CHRNB2 (0.37) | — | |
| SCHEMBL7363814 | 0.57 | — | — | |
| SCHEMBL16033512 | 0.57 | CYP2C9 (0.41) | — | |
| SCHEMBL1761782 | 0.57 | — | — | |
| SCHEMBL15466711 | 0.57 | — | — | |
| SCHEMBL15955910 | 0.56 | — | — |
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 10 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5717098-A | GAMMA-LACTONE CHEMICAL INTERMEDIATE, USED TO PRODUCE A SINGLE ENANTIOMER OF AMINOAZANORADAMANTANE WHICH IS COUPLED TO AROMATIC ACID DERIVEATIVE TO PRODUCE A COMPOUND USEFUL AS 5-HT-AGONISTS OR ANTAGONSITS | G. D. SEARLE & CO. (US) | 1998-02-10 | — | — | US | claimed |
| WO-1996000729-A2 | PROCESS FOR THE PREPARATION OF AZANORADAMANTANE BENZAMIDES | G.D. SEARLE & CO. (US) | 1996-01-11 | — | — | WO | claimed |
| US-5717098-A | GAMMA-LACTONE CHEMICAL INTERMEDIATE, USED TO PRODUCE A SINGLE ENANTIOMER OF AMINOAZANORADAMANTANE WHICH IS COUPLED TO AROMATIC ACID DERIVEATIVE TO PRODUCE A COMPOUND USEFUL AS 5-HT-AGONISTS OR ANTAGONSITS | G. D. SEARLE & CO. (US) | 1998-02-10 | — | — | US | disclosed |
| US-5717098-A | GAMMA-LACTONE CHEMICAL INTERMEDIATE, USED TO PRODUCE A SINGLE ENANTIOMER OF AMINOAZANORADAMANTANE WHICH IS COUPLED TO AROMATIC ACID DERIVEATIVE TO PRODUCE A COMPOUND USEFUL AS 5-HT-AGONISTS OR ANTAGONSITS | G. D. SEARLE & CO. (US) | 1998-02-10 | — | — | US | disclosed |
| US-5650535-A | FORMING NORBORNENE BY CHEMICAL CONDENSATION OF UNSATURATED ESTER WITH CYCLOPENTADIENE IN TRIETHYLAMINE | G. D. SEARLE & CO. (US) | 1997-07-22 | — | — | US | disclosed |
| US-5650535-A | FORMING NORBORNENE BY CHEMICAL CONDENSATION OF UNSATURATED ESTER WITH CYCLOPENTADIENE IN TRIETHYLAMINE | G. D. SEARLE & CO. (US) | 1997-07-22 | — | — | US | disclosed |
| US-5541344-A | 5-HT AGONISTS, ANTAGONISTS, IODINATED TRICYLIC LACTONES | G. D. SEARLE & CO. (US) | 1996-07-30 | — | — | US | disclosed |
| WO-1996000729-A3 | PROCESS FOR THE PREPARATION OF AZANORADAMANTANE BENZAMIDES | SEARLE & CO (US) | 1996-02-15 | — | — | WO | disclosed |
| WO-1996000729-A2 | PROCESS FOR THE PREPARATION OF AZANORADAMANTANE BENZAMIDES | G.D. SEARLE & CO. (US) | 1996-01-11 | — | — | WO | disclosed |
| WO-1996000729-A2 | PROCESS FOR THE PREPARATION OF AZANORADAMANTANE BENZAMIDES | G.D. SEARLE & CO. (US) | 1996-01-11 | — | — | WO | disclosed |