SCHEMBL1726

SCHEMBL1726

[CH2]C#Cc1ccccc1

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
SCHEMBL7016815 0.84 CYP1A2 (0.60) —
SCHEMBL9433745 0.80 APP (0.55) —
Diphenylacetylene SCHEMBL68254 0.79 APP (1.00) —
Diphenylacetylene SCHEMBL29188592 0.79 APP (1.00) —
Diphenylacetylene SCHEMBL960609 0.79 APP (1.00) —
SCHEMBL19439474 0.79 APP (0.61) —
Diphenylacetylene SCHEMBL23754282 0.76 APP (0.92) —
Diphenylacetylene SCHEMBL9273707 0.76 APP (0.92) —
Diphenylacetylene SCHEMBL31243352 0.76 APP (0.92) —
Diphenylacetylene SCHEMBL31286315 0.76 APP (0.92) —

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 1381 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117946025-A 1-Oxygen-2, 8-diazacyclic sunflower ketone derivative and synthetic method and application thereof 广西师范大学 2024-04-30 — — CN claimed
CN-117945823-A Method for preparing sulfenamide by condensing sodium sulfenate and aromatic amine under catalysis of chiral pyridine nitrogen oxide 河南师范大学 2024-04-30 — — CN claimed
WO-2024083670-A2 BROMINE- OR IODINE-PARA-SUBSTITUTED [(1,5-DIPHENYL-1H-1,2,4-TRIAZOL-3-YL)OXY]ACETIC ACID DERIVATIVES AND THEIR SALTS, AGENTS FOR PROTECTING USEFUL PLANTS OR CROP PLANTS COMPRISING THEM, METHODS FOR PRODUCING THEM AND THEIR USE AS SAFENERS BAYER AKTIENGESELLSCHAFT (DE) 2024-04-25 — — WO claimed
WO-2024083671-A1 BROMINE- OR IODINE-PARA-SUBSTITUTED [(1,5-DIPHENYL-1H-1,2,4-TRIAZOL-3-YL)OXY]ACETIC ACID DERIVATIVES AND SALTS THEREOF, PROTECTION AGENTS COMPRISING THEM, FOR USEFUL PLANTS OR CROP PLANTS, METHODS FOR PRODUCING THEM AND USE THEREOF AS SAFENERS BAYER AKTIENGESELLSCHAFT (DE) 2024-04-25 — — WO claimed
EP-4337017-A1 HERBICIDE/SAFENER COMBINATION BASED ON SAFENERS FROM THE CLASS OF SUBSTITUTED [(1,5-DIPHENYL-1H-1,2,4-TRIAZOL-3-YL)OXY]ACETIC ACIDS AND THEIR SALTS Bayer Aktiengesellschaft (DE) 2024-03-20 — — EP claimed
US-20240067623-A1 [(1-PHENYL-5-HETEROARYL-1H-PYRAZOL-3-YL)OXY] ACETIC ACID DERIVATIVES AS SAFENERS FOR THE PROTECTION OF USEFUL PLANTS AND CROP PLANTS BAYER AKTIENGESELLSCHAFT (DE) 2024-02-29 — — US claimed
CN-117466703-A Method for synthesizing phenyl propargyl fluoride compound by sulfur hexafluoride 国网安徽省电力有限公司电力科学研究院 2024-01-30 — — CN claimed
CN-117320553-A Herbicide/safener combinations based on substituted [ (1,5-diphenyl-1H-1,2,4-triazol-3-yl) oxy ] acetic acid and its salt safeners 拜耳公司 2023-12-29 — — CN claimed
US-20230416229-A1 [(1,5-DIHETEROARYL-1H-1,2,4-TRIAZOL-3-YL)OXY] ACETIC ACID DERIVATIVES AS SAFENERS FOR THE PROTECTION OF USEFUL PLANTS AND CROP PLANTS BAYER AKTIENGESELLSCHAFT (DE) 2023-12-28 — — US claimed
US-20230397604-A1 [(1-PHENYL-5-(HETEROARYL)-1H-1,2,4-TRIAZOL-3-YL)OXY] ACETIC ACID DERIVATIVES AS SAFENERS FOR THE PROTECTION OF USEFUL PLANTS AND CROP PLANTS BAYER AKTIENGELLSCHAFT (DE) 2023-12-14 — — US claimed
US-4826965-A Metal complexes containing optically active sugar ligands, a process for their preparation and their use as chiral reactants for synthesis of alcohols and amines CIBA-GEIGY CORPORATION (US) 1989-05-02 — — US claimed
EP-0254685-A2 Complexes with optically active sugar ligands, process for their preparation and their use CIBA-GEIGY AG (CH) 1988-01-27 — — EP claimed
US-4672068-A Antihypertensive 1,4-dihydropyridines having a conjugated ester FUJIREBIO KABUSHIKI KAISHA (JP) 1987-06-09 — — US claimed
US-4381310-A Antimycotic substituted 2,4-dichlorophenyl-imidazolyl-vinyl-carbinols BAYER AKTIENGESELLSCHAFT (DE) 1983-04-26 — — US claimed
EP-0010297-B1 DERIVATIVES OF POLYENE MACROLIDE ANTIBIOTICS CONTAINING AN AMINO SUGAR MOIETY, PROCESS FOR THE PREPARATION THEREOF, AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM SCHERING CORPORATION (US) 1983-04-13 — — EP claimed
EP-0048828-A1 Substituted 2,4-dichlorophenyl-imidazolyl-vinyl carbinols, process for their preparation and antimicrobial agents containing these compounds BAYER AG (DE) 1982-04-07 — — EP claimed
EP-0048827-A1 Substituted 2,4-dichlorophenyl-imidazolyl-vinyl ketones, processes for their preparation and antimicrobial agents containing these compounds BAYER AG (DE) 1982-04-07 — — EP claimed
US-4272525-A FUNGICIDES SCHERING CORPORATION (US) 1981-06-09 — — US claimed
EP-0010297-A1 Derivatives of polyene macrolide antibiotics containing an amino sugar moiety, process for the preparation thereof, and pharmaceutical compositions containing them SCHERING CORPORATION (US) 1980-04-30 — — EP claimed
US-3991199-A ANALGESICS AND SEDATIVES ENDO LABORATORIES, INC. (US) 1976-11-09 — — US claimed
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