SCHEMBL175607

SCHEMBL175607

C=CCc1cs[nH]c1=O

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
SCHEMBL3226473 0.64 GABRA1 (0.38)
SCHEMBL4636541 0.62 PDPK1 (0.34)
SCHEMBL16916950 0.62 ALDH1A1 (0.41)
SCHEMBL7560512 0.61 NPSR1 (0.35)
SCHEMBL2074570 0.61 DAO (0.42)
SCHEMBL175877 0.61 DPYD (0.52)
SCHEMBL1595423 0.61 GABRA1 (0.35)
SCHEMBL11881896 0.60 GABRA1 (0.40)
SCHEMBL5926320 0.60 ADRA2B (0.34)
SCHEMBL29281370 0.60 ALDH1A1 (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 77 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7229489-B2 Water-color ink composition SEIKO EPSON CORPORATION (JP) 2007-06-12 US claimed
US-20060016370-A1 Containing 2-butyl-2-ethyl-1,3-propanediol and a 1,2-alkylene glycol to improve storage stability and to provide high print qualityon ordinary paper, recycled paper or coated paper SEIKO EPSON CORPORATION 2006-01-26 US claimed
CN-117915774-A Novel insecticidal compositions comprising elemental sulfur and Acynonapyr 希特逊库玛·阿尼凯特·多希 2024-04-19 CN disclosed
CN-116322328-A Pesticide composition comprising elemental sulphur and choline salts of pelargonic acid 希特逊库玛·阿尼凯特·多希 2023-06-23 CN disclosed
CN-116193988-A Pesticide composition containing elemental sulfur and flurofuranone 希特逊库玛·阿尼凯特·多希 2023-05-30 CN disclosed
CN-115515425-A Synergistic fungicidal interaction of picolinamide fungicides with other fungicides against asian soybean rust 科迪华农业科技有限责任公司 2022-12-23 CN disclosed
US-11319454-B2 Polyurethane-based binder dispersion HEWLETT-PACKARD DEVELOPMENT COMPANY, L.P. (US) 2022-05-03 US disclosed
WO-2022081133-A1 MODIFIED POROUS WICKING MEMBRANES HEWLETT-PACKARD DEVELOPMENT COMPANY, L.P. (US) 2022-04-21 WO disclosed
WO-2022005467-A1 HYDROPHOBIC FLOW BARRIERS HEWLETT-PACKARD DEVELOPMENT COMPANY, L.P. (US) 2022-01-06 WO disclosed
WO-2022005468-A1 HYDROPHOBIC FLOW BARRIERS HEWLETT-PACKARD DEVELOPMENT COMPANY, L.P. (US) 2022-01-06 WO disclosed
EP-3532524-B1 POLYURETHANE-BASED BINDER DISPERSION HEWLETT PACKARD DEVELOPMENT CO (US) 2021-12-01 EP disclosed
US-20020088375-A1 Surface treating a pigment to introduce a hydrophilic dispersibility- imparting group, dispersing pigment in aqueous medium, refining; for example treating carbon black with sulfur trioxide to sulfonate it SEIKO EPSON CORPORATION 2002-07-11 US disclosed
EP-1219689-A1 Black ink composition, ink set, recording method, recording matter and ink jet recording device SEIKO EPSON CORPORATION (JP) 2002-07-03 EP disclosed
CN-1316188-A Control release composition ROHM & HAAS (US) 2001-10-10 CN disclosed
CN-1286026-A Isothiazolone concentrate ROHM & HAAS (US) 2001-03-07 CN disclosed
US-5717007-A MARINE APPLICATIONS ETAT FRANCAIS AS REPRESENTED BY THE DELEGUE GENERAL POUR L'ARMEMENT (FR) 1998-02-10 US disclosed
US-5420290-A Amidation of dimethyl dithiopropionate to form dithioamide, chlorination and neutralization ROHM AND HAAS COMPANY (US) 1995-05-30 US disclosed
US-5312827-A Nitrosamine-free-3-isothiazolones and process ROHM AND HAAS COMPANY (US) 1994-05-17 US disclosed
US-5068338-A Amidation of methyl 3-mercaptopropionate with methylamine, cyclization, chlorination and adding a metal nitrate ROHM AND HAAS COMPANY (US) 1991-11-26 US disclosed
US-4939266-A NUCLEOPHILIC SCAVENGER ROHM AND HAAS COMPANY (US) 1990-07-03 US disclosed