⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2784162 | 0.71 | KDM4E (0.36) | — | |
| SCHEMBL11130275 | 0.69 | — | — | |
| SCHEMBL10741926 | 0.69 | — | — | |
| SCHEMBL725601 | 0.68 | — | — | |
| SCHEMBL11038490 | 0.67 | — | — | |
| SCHEMBL2840373 | 0.67 | — | — | |
| SCHEMBL876216 | 0.67 | — | — | |
| SCHEMBL7113506 | 0.67 | — | — | |
| SCHEMBL15190357 | 0.67 | — | — | |
| SCHEMBL6386528 | 0.67 | POLB (0.32) | — |
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 13 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20040059128-A1 | Method of producing 1-alkyl-3-aryl-5-difluoromethoxy-ih-pyrazoles | BASF AKTIENGESELLSCHAFT (DE) | 2004-03-25 | — | — | US | claimed |
| EP-1358164-A1 | METHOD OF PRODUCING 1-ALKYL-3-ARYL-5-DIFLUOROMETHOXY-1H-PYRAZOLES | BASF AKTIENGESELLSCHAFT (DE) | 2003-11-05 | — | — | EP | claimed |
| WO-2002055504-A1 | METHOD OF PRODUCING 1-ALKYL-3-ARYL-5-DIFLUOROMETHOXY-1H-PYRAZOLES | BASF AKTIENGESELLSCHAFT (DE) | 2002-07-18 | — | — | WO | claimed |
| JP-6199806-A | — | — | None | — | — | JP | disclosed |
| US-12545684-B2 | CDK2 inhibitors | BLUEPRINT MEDICINES CORPORATION (US) | 2026-02-10 | — | — | US | disclosed |
| US-20240383902-A1 | CDK2 INHIBITORS | BLUEPRINT MEDICINES CORPORATION | 2024-11-21 | — | — | US | disclosed |
| CN-117229278-A | Synthesis method of trifluoromethyl-bis-isothiazolinone-difluoromethoxy pyrazole compound | 宁夏佰斯特医药化工有限公司 | 2023-12-15 | — | — | CN | disclosed |
| CN-114829360-A | Process for the preparation of [ 3-chloro-2- [3- [2- [1- (2-chloroacetyl) -4-piperidinyl ] thiazol-4-yl ] -4, 5-dihydroisoxazol-5-yl ] phenyl ] methanesulfonate | 拜耳公司 | 2022-07-29 | — | — | CN | disclosed |
| US-6897322-B2 | Method of producing 1-alkyl-3-aryl-5-difluoromethoxy-1H-pyrazoles | BASF AKTIENGESELLSCHAFT (DE) | 2005-05-24 | — | — | US | disclosed |
| US-20040059128-A1 | Method of producing 1-alkyl-3-aryl-5-difluoromethoxy-ih-pyrazoles | BASF AKTIENGESELLSCHAFT (DE) | 2004-03-25 | — | — | US | disclosed |
| US-6545033-B1 | GABA receptor inhibitors | 3-DIMENSIONAL PHARMACEUTICALS, INC. | 2003-04-08 | — | — | US | disclosed |
| WO-2001025241-A2 | FUSED 1-(2,6-DICHLORO-4-TRIFLUOROMETHYLPHENYL)-PYRAZOLES, THE SYNTHESIS THEREOF AND THE USE THEREOF AS PESTICIDES | 3-DIMENSIONAL PHARMACEUTICALS, INC. (US) | 2001-04-12 | — | — | WO | disclosed |
| JP-H06199806-A | DIFLUOROMETHOXYPYRAZOLE DERIVATIVE AND ITS PRODUCTION | NIPPON NOHYAKU CO LTD | 1994-07-19 | — | — | JP | disclosed |