⚠ 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 | |
|---|---|---|---|---|
| Isoxazole SCHEMBL11568599 | 0.92 | — | — | |
| Isoxazole SCHEMBL8414240 | 0.90 | — | — | |
| Isoxazole SCHEMBL22467457 | 0.88 | — | — | |
| Isoxazole SCHEMBL9196311 | 0.84 | PARP1 (0.56) | — | |
| Benzene SCHEMBL27337742 | 0.84 | PARP1 (0.93) | — | |
| Isoxazole SCHEMBL28930409 | 0.82 | — | — | |
| Isoxazole SCHEMBL6504498 | 0.82 | — | — | |
| Benzamide SCHEMBL3346807 | 0.82 | PARP1 (0.59) | — | |
| Malonic Acid SCHEMBL30157181 | 0.81 | PARP1 (0.59) | — | |
| Fumaric Acid SCHEMBL10715114 | 0.81 | PARP1 (0.59) | — |
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 94 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0638074-B1 | ISOXAZOLE CARBOXYLIC ACID AMIDES, PROCESS FOR PRODUCING THEM AND THEIR USE | BASF AG (DE) | 1999-03-31 | — | — | EP | claimed |
| EP-0638074-A1 | ISOXAZOLE CARBOXYLIC ACID AMIDES, PROCESS FOR PRODUCING THEM AND THEIR USE | BASF Aktiengesellschaft (DE) | 1995-02-15 | — | — | EP | claimed |
| WO-1993022295-A1 | ISOXAZOLE CARBOXYLIC ACID AMIDES, PROCESS FOR PRODUCING THEM AND THEIR USE | BASF AKTIENGESELLSCHAFT (DE) | 1993-11-11 | — | — | WO | claimed |
| EP-3986553-B1 | CYCLOBUTYL CARBOXYLIC ACIDS AS LPA ANTAGONISTS | BRISTOL MYERS SQUIBB CO (US) | 2026-03-25 | — | — | EP | disclosed |
| US-12466804-B2 | Cyclobutyl carboxylic acids as LPA antagonists | BRISTOL-MYERS SQUIBB COMPANY (US) | 2025-11-11 | — | — | US | disclosed |
| US-12454530-B2 | Amido cyclohexane acid derivatives as LPA receptor inhibitors | CHIESI FARMACEUTICI S.P.A. (IT) | 2025-10-28 | — | — | US | disclosed |
| US-12428430-B2 | Oxabicyclo acids as LPA antagonists | BRISTOL-MYERS SQUIBB COMPANY (US) | 2025-09-30 | — | — | US | disclosed |
| US-12384768-B2 | Isoxazole carboxylic acids as LPA antagonists | BRISTOL-MYERS SQUIBB COMPANY (US) | 2025-08-12 | — | — | US | disclosed |
| CN-112041304-B | Isoxazole N-linked carbamoyl cyclohexyl acids as LPA antagonists | 百时美施贵宝公司 | 2025-03-07 | — | — | CN | disclosed |
| US-20250066341-A1 | CYCLOHEXANE ACID DERIVATIVES AS LPA RECEPTOR INHIBITORS | CHIESI FARMACEUTICI S.P.A. (IT) | 2025-02-27 | — | — | US | disclosed |
| US-12209072-B2 | Cyclopentyl acids as LPA antagonists | BRISTOL-MYERS SQUIBB COMPANY (US) | 2025-01-28 | — | — | US | disclosed |
| CN-1066071-A | 6-heterocyclic radical-4-amino-1,2,2a, 3,4, the 5-hexahydrobenzene is [cd] indoles also | LILLY CO ELI (US) | 1992-11-11 | — | — | CN | disclosed |
| CN-1066072-A | 6-heterocyclic-4-amino-1, 3, 4, 5-tetrahydrobenzo [ cd ] indoles | LILLY CO ELI (US) | 1992-11-11 | — | — | CN | disclosed |
| EP-0506369-A1 | 6-Heterocyclic-4-amino-1,2,2a,3,4,5-hexahydrobenz[CD]indoles | ELI LILLY AND COMPANY (US) | 1992-09-30 | — | — | EP | disclosed |
| EP-0506363-A1 | 6-Heterocyclic-4-amino-1,3,4,5-tetrahydrobenz[cd]indoles | ELI LILLY AND COMPANY (US) | 1992-09-30 | — | — | EP | disclosed |
| EP-0193131-B1 | 5-ISOXAZOLECARBOXAMIDES, THEIR PREPARATION AND THEIR USE AS FUNGICIDES | BASF Aktiengesellschaft (DE) | 1989-12-06 | — | — | EP | disclosed |
| EP-0193131-A1 | 5-Isoxazolecarboxamides, their preparation and their use as fungicides | BASF Aktiengesellschaft (DE) | 1986-09-03 | — | — | EP | disclosed |
| EP-0080080-A1 | Isoxazolecarboxylic-acid amides, their preparation and their utilization as fungicides | BASF Aktiengesellschaft (DE) | 1983-06-01 | — | — | EP | disclosed |
| EP-0080080-A1 | Isoxazolecarboxylic-acid amides, their preparation and their utilization as fungicides | BASF Aktiengesellschaft (DE) | 1983-06-01 | — | — | EP | disclosed |
| EP-0044185-A2 | Imidazolidinone derivatives | ELI LILLY AND COMPANY (US) | 1982-01-20 | — | — | EP | disclosed |