SCHEMBL1789251

SCHEMBL1789251

CCC=C(C)C(=O)Cl

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
SCHEMBL5167298 1.00
Ammonia Solution, Strong SCHEMBL9685208 0.97
Trimethylammonium SCHEMBL17512955 0.93 ALDH1A1 (0.33)
Trimethylammonium SCHEMBL8742135 0.93 ALDH1A1 (0.33)
SCHEMBL9186898 0.79 PTGS1 (0.37)
SCHEMBL9186910 0.79 PTGS1 (0.37)
SCHEMBL8527282 0.79
SCHEMBL22064824 0.79
SCHEMBL14712303 0.77
SCHEMBL10454083 0.77 ALDH1A1 (0.37)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0695423-A4 POLYMER CONTAINING CONTROL REAGENTS AND POLYMERS USEFUL IN CONTROL REAGENTS BOEHRINGER MANNHEIM CORP (US) 1998-07-29 EP claimed
EP-0695423-A1 POLYMER CONTAINING CONTROL REAGENTS AND POLYMERS USEFUL IN CONTROL REAGENTS BOEHRINGER MANNHEIM CORPORATION (US) 1996-02-07 EP claimed
WO-1994024551-A1 POLYMER CONTAINING CONTROL REAGENTS AND POLYMERS USEFUL IN CONTROL REAGENTS BOEHRINGER MANNHEIM CORPORATION (US) 1994-10-27 WO claimed
US-4517381-A HERBICIDES MITSUI TOATSU CHEMICALS, INC. (JP) 1985-05-14 US claimed
JP-60023357-A None JP disclosed
EP-4725903-A1 POROUS SILICON COMPOUND Covestro (Netherlands) B.V. (NL) 2026-04-15 EP disclosed
US-20250313523-A1 FRAGRANCE AND FLAVOR COMPOSITIONS COMPRISING NORBORNANE AND NORBORNENE DERIVATIVES OSMO LABS, PBC 2025-10-09 US disclosed
EP-4582092-A1 COMPOSITION CONTAINING PEPTIDE, SURFACTANT, AND POLYMER CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2025-07-09 EP disclosed
CN-111433958-B Anion exchange membranes for redox flow batteries 懿华水处理技术有限责任公司 2024-08-27 CN disclosed
WO-2024080308-A1 COMPOSITION CONTAINING PEPTIDE, SURFACTANT, AND POLYMER 中外製薬株式会社 2024-04-18 WO disclosed
US-11929533-B2 Anion exchange membranes for redox flow batteries EVOQUA WATER TECHNOLOGIES LLC (US) 2024-03-12 US disclosed
EP-3608016-B1 HYBRID ORGANIC-INORGANIC NANO-PARTICLES COVESTRO NETHERLANDS BV (NL) 2023-11-15 EP disclosed
US-20040192804-A1 Photosensitive resin composition IGM GROUP B.V. (NL) 2004-09-30 US disclosed
US-6365771-B1 CURABLE VINYL ETHER OR METHACRYLATE DERIVATIVES OF 4,7 METHANOINDENE OR INDANE; PHOTORESISTS, OPTICS, AND COATINGS NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2002-04-02 US disclosed
EP-1112995-A1 ALICYCLIC COMPOUNDS AND CURABLE RESIN COMPOSITION Nissan Chemical Industries, Ltd. (JP) 2001-07-04 EP disclosed
US-4600576-A FOODS, PERFUMES INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1986-07-15 US disclosed
US-4565764-A COLORED CORE MATERIAL COATED WITH RESIN WALLS CANON KABUSHIKI KAISHA (JP) 1986-01-21 US disclosed
US-4517381-A HERBICIDES MITSUI TOATSU CHEMICALS, INC. (JP) 1985-05-14 US disclosed
JP-S6023357-A 2-METHYL-4'-ISOPROPYL-2-PENTENOYLANILIDE AND SELECTIVE HERBICIDE MITSUI TOATSU CHEM INC 1985-02-05 JP disclosed
US-4383849-A 2,3-Dihydro-4-pyrone derivatives, their preparation the herbicidal compositions in which they are present and their use for selectively destroying weeds in crops RHONE-POULENC AGROCHIMIE (FR) 1983-05-17 US disclosed