SCHEMBL3825294

SCHEMBL3825294

CC1CCCCC1(CC1(N=C=O)CCCCC1C)N=C=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
SCHEMBL1890237 0.76 ALDH1A1 (0.36)
SCHEMBL93325 0.75 ALDH1A1 (0.32)
SCHEMBL2048546 0.73 ALDH1A1 (0.31)
SCHEMBL10479861 0.71
SCHEMBL2692824 0.70
SCHEMBL229600 0.70 ALDH1A1 (0.34)
SCHEMBL8071920 0.69
SCHEMBL17646462 0.69 ALDH1A1 (0.32)
SCHEMBL231682 0.68 ALDH1A1 (0.32)
SCHEMBL7156968 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 16 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10730992-B2 Curable composition, adhesive, article having coating layer, fiber-reinforced composite material and curable composition kit MITSUBISHI CHEMICAL CORPORATION (JP) 2020-08-04 US disclosed
US-20180244835-A1 CURABLE COMPOSITION, ADHESIVE, ARTICLE HAVING COATING LAYER, FIBER-REINFORCED COMPOSITE MATERIAL, POTTING AGENT AND CURABLE COMPOSITION KIT MITSUBISHI CHEMICAL CORPORATION (JP) 2018-08-30 US disclosed
US-20180237576-A1 CURABLE COMPOSITION, ADHESIVE, ARTICLE HAVING COATING LAYER, FIBER-REINFORCED COMPOSITE MATERIAL AND CURABLE COMPOSITION KIT MITSUBISHI CHEMICAL CORPORATION (JP) 2018-08-23 US disclosed
EP-1524289-B1 POLYMERIZABLE COMPOSITION, OPTICAL MATERIAL COMPRISING THE COMPOSITION AND METHOD FOR PRODUCING THE MATERIAL MITSUBISHI GAS CHEMICAL CO (JP) 2009-09-16 EP disclosed
US-20090091825-A1 Plastic Polarized Lens SEIKO EPSON CORPORATION (JP) 2009-04-09 US disclosed
US-20070149639-A1 Polymerizable composition, optical material comprising the composition and method for producing the material HORIKOSHI HIROSHI 2007-06-28 US disclosed
EP-1138670-B1 Polythiol, polymerizable composition, resin and lens, and process for preparing thiol compound MITSUI CHEMICALS INC (JP) 2005-05-25 EP disclosed
EP-1524289-A1 POLYMERIZABLE COMPOSITION, OPTICAL MATERIAL COMPRISING THE COMPOSITION AND METHOD FOR PRODUCING THE MATERIAL MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2005-04-20 EP disclosed
US-20040254258-A1 Polymerizable composition, optical material comprising the composition and method for producing the material MITSUBISHI GAS CHEMICAL CO., LTD. (JP) 2004-12-16 US disclosed
US-6770735-B2 ORGANIC SULFIDES SUCH AS 1,1,3,3-TETRAKIS(MERCAPTOMETHYLTHIO) PROPANE, USED TO FORM RESINS HAVING HIGH REFRACTIVE INDEX, IMPACT STRENGTH AND HEAT REISTANCE, FOR USE AS LENSES, PRISMS OR OPTICAL FIBER AND FILTERS MITSUI CHEMICALS, INC. (JP) 2004-08-03 US disclosed
US-6770734-B2 POLYMERIZABLE TO MAKE POLYTHIOURETHANES; LENSES WITH A HIGH REFRACTIVE INDEX MITSUI CHEMICALS, INC. (JP) 2004-08-03 US disclosed
US-20030199668-A1 Process for preparing a thiol compound MITSUI CHEMICALS, INC. (JP) 2003-10-23 US disclosed
US-20030149230-A1 Polythiol compound MITSUI CHEMICALS, INC. (JP) 2003-08-07 US disclosed
US-6596841-B2 For producing resin which is used for optical material such as a plastic lens, a prism, an optical fiber, a substrate for an information recording medium, a filter and a light emitting diodes; refractive index MITSUI CHEMICALS, INC. (JP) 2003-07-22 US disclosed
US-20020022713-A1 Polythiol, polymerizable composition, resin and lens, and process for preparing thiol compound MITSUI CHEMICALS, INC. (JP) 2002-02-21 US disclosed
EP-1138670-A1 Polythiol, polymerizable composition, resin and lens, and process for preparing thiol compound Mitsui Chemicals, Inc. (JP) 2001-10-04 EP disclosed