⚠ 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL10999756 | 0.98 | HCAR2 (0.55) | — | |
| SCHEMBL3131538 | 0.80 | — | — | |
| SCHEMBL1641444 | 0.80 | — | — | |
| SCHEMBL9819411 | 0.80 | — | — | |
| SCHEMBL568129 | 0.77 | CHRNA4 (0.43) | — | |
| SCHEMBL6074169 | 0.77 | CHRNA4 (0.43) | — | |
| SCHEMBL2806245 | 0.76 | HCAR2 (0.61) | — | |
| SCHEMBL15004589 | 0.75 | CHRNA4 (0.42) | — | |
| SCHEMBL630565 | 0.74 | — | — | |
| SCHEMBL11619922 | 0.74 | PTPN1 (0.57) | — |
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 71 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0016255-B1 | ISOXAZOLE DERIVATIVE, PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME | ZAMBON S.p.A. (IT) | 1983-09-28 | — | — | EP | claimed |
| EP-0016255-A2 | Isoxazole derivative, preparation thereof and pharmaceutical compositions containing the same | ZAMBON S.p.A. (IT) | 1980-10-01 | — | — | EP | claimed |
| EP-2064194-B1 | N-HYDROXYAMIDINOHETEROCYCLIC COMPOUNDS AS MODULATORS OF INDOLEAMINE 2,3-DIOXYGENASE | INCYTE HOLDINGS CORP (US) | 2018-11-07 | — | — | EP | disclosed |
| EP-2346868-B1 | AZAINDAZOLE COMPOUNDS AS CCR1 RECEPTOR ANTAGONISTS | BOEHRINGER INGELHEIM INT (DE) | 2016-01-27 | — | — | EP | disclosed |
| EP-2346868-B1 | AZAINDAZOLE COMPOUNDS AS CCR1 RECEPTOR ANTAGONISTS | BOEHRINGER INGELHEIM INT (DE) | 2016-01-27 | — | — | EP | disclosed |
| US-20130296279-A1 | SUBSTITUTED TETRACYCLINES | CONCERT PHARMACEUTICALS INC. | 2013-11-07 | — | — | US | disclosed |
| US-20130296279-A1 | SUBSTITUTED TETRACYCLINES | CONCERT PHARMACEUTICALS INC. | 2013-11-07 | — | — | US | disclosed |
| US-20130296279-A1 | SUBSTITUTED TETRACYCLINES | CONCERT PHARMACEUTICALS INC. | 2013-11-07 | — | — | US | disclosed |
| US-8507541-B2 | N-hydroxyamidinoheterocycles as modulators of indoleamine 2,3-dioxygenase | INCYTE CORPORATION (US) | 2013-08-13 | — | — | US | disclosed |
| US-8338610-B2 | Pyridinyl compounds useful as intermediates | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2012-12-25 | — | — | US | disclosed |
| US-8338610-B2 | Pyridinyl compounds useful as intermediates | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2012-12-25 | — | — | US | disclosed |
| EP-0207955-A1 | PROCESS FOR THE PREPARATION OF 3,5-DISUBSTITUTED ISOXAZOLES. | ZAMBON SPA (IT) | 1987-01-14 | — | — | EP | disclosed |
| WO-1986003490-A1 | PROCESS FOR THE PREPARATION OF 3,5-DISUBSTITUTED ISOXAZOLES | ZAMBON S.P.A. (IT) | 1986-06-19 | — | — | WO | disclosed |
| US-4520200-A | CHEMICAL INTERMEDIATES FOR BRONCHODILATOR AGENT | ZAMBON S.P.A. (IT) | 1985-05-28 | — | — | US | disclosed |
| US-4520200-A | CHEMICAL INTERMEDIATES FOR BRONCHODILATOR AGENT | ZAMBON S.P.A. (IT) | 1985-05-28 | — | — | US | disclosed |
| EP-0016255-B1 | ISOXAZOLE DERIVATIVE, PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME | ZAMBON S.p.A. (IT) | 1983-09-28 | — | — | EP | disclosed |
| US-4276299-A | BRONCHODILATOR AGENTS | ZAMBON S.P.A. (IT) | 1981-06-30 | — | — | US | disclosed |
| US-4276299-A | BRONCHODILATOR AGENTS | ZAMBON S.P.A. (IT) | 1981-06-30 | — | — | US | disclosed |
| EP-0016255-A2 | Isoxazole derivative, preparation thereof and pharmaceutical compositions containing the same | ZAMBON S.p.A. (IT) | 1980-10-01 | — | — | EP | disclosed |
| EP-0016255-A2 | Isoxazole derivative, preparation thereof and pharmaceutical compositions containing the same | ZAMBON S.p.A. (IT) | 1980-10-01 | — | — | EP | disclosed |