SCHEMBL395056

SCHEMBL395056

O=C(C(F)F)C(F)(Br)Br

nearest known ligand 0.00

⚠ 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.

Compoundsimilaritytop predictedshared targets
SCHEMBL891845 0.73
SCHEMBL11365878 0.69
SCHEMBL891818 0.69 THRB (0.32)
SCHEMBL9935879 0.69
SCHEMBL9935877 0.69
SCHEMBL2884062 0.69 PKM (0.39)
SCHEMBL9935040 0.69
SCHEMBL4604253 0.67
SCHEMBL22208158 0.67 ALDH1A1 (0.32)
Water SCHEMBL27655125 0.67

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 65 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117624129-A Synthesis method of RAF265 inhibitor 上海图芃生物科技有限公司 2024-03-01 CN claimed
CN-118369094-A Process for preparing substituted pyrazolopyrimidines KSQ治疗公司 2024-07-19 CN disclosed
CN-118103362-A Herbicidal imidazole compounds 先正达农作物保护股份公司 2024-05-28 CN disclosed
CN-111132979-B Benzoxazinone derivatives as herbicides 瑞戴格作物保护公司 2024-03-26 CN disclosed
CN-117624129-A Synthesis method of RAF265 inhibitor 上海图芃生物科技有限公司 2024-03-01 CN disclosed
CN-117460718-A Triazine derivatives and their use in the treatment of cancer 豪夫迈·罗氏有限公司 2024-01-26 CN disclosed
CN-117263944-A Ubiquitin-specific protease 1 inhibitors and uses thereof 轩竹生物科技股份有限公司 2023-12-22 CN disclosed
CN-117136189-A Ubiquitin-specific protease 1 (USP 1) inhibitors 先声再明医药有限公司 2023-11-28 CN disclosed
CN-116925098-A Small molecule inhibitor targeting ubiquitin-specific protease 1 (USP 1) and application thereof 深圳湾实验室 2023-10-24 CN disclosed
CN-116813619-A Macrocyclic inhibitors of Wee1 南京正大天晴制药有限公司 2023-09-29 CN disclosed
US-4853383-A β-blocking substituted imidazoles MERCK & CO., INC. (US) 1989-08-01 US disclosed
EP-0229922-A2 Novel 2,2'-BI-1H-imidazoles MERRELL DOW PHARMACEUTICALS INC. (US) 1987-07-29 EP disclosed
US-4642311-A β-adrenergic blocking imidazolylphenoxy propanolamines MERCK & CO., INC. (US) 1987-02-10 US disclosed
US-4567276-A HYPOTENSIVE AGENTS, ADRENERGIC BLOCKING AGENTS MERCK & CO., INC. (US) 1986-01-28 US disclosed
US-4559354-A ADRENERGIC BLOCKING AGENTS AND STIMULANTS; CARDIOTONIC, ANTIARRHYTHMIA AND INOTROPIC AGENTS CIBA-GEIGY CORPORATION (US) 1985-12-17 US disclosed
US-4440774-A ANTIHYPERTENSIVE AGENTS AND B-ANDRENERGIC BLOCKING AGENTS MERCK & CO., INC. (US) 1984-04-03 US disclosed
US-4199580-A HYPOTENSIVE AGENTS AND ADRENERGIC BLOCKING AGENTS MERCK & CO., INC. (US) 1980-04-22 US disclosed
US-4134983-A HYPOTENSIVE, ADRENERGIC BLOCKING AGENTS MERCK & CO., INC. (US) 1979-01-16 US disclosed
US-4125530-A FROM 1,1-DIHALO-3,3,3-TRIFLUOROACETONE, BASE, AMMONIA AND A CARBOXALDEHYDE MERCK & CO., INC. (US) 1978-11-14 US disclosed
US-4032522-A ANTI-GOUT, ANTI-HYPERURICEMIC MERCK & CO., INC. (US) 1977-06-28 US disclosed