SCHEMBL252969

SCHEMBL252969

CCC#CC(C)(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
SCHEMBL5613286 0.81
SCHEMBL14085354 0.80 ALDH1A1 (0.46)
SCHEMBL3108062 0.77
SCHEMBL28946685 0.77
SCHEMBL8471055 0.77
SCHEMBL5613293 0.75
SCHEMBL3960849 0.73
SCHEMBL5996892 0.73
SCHEMBL468111 0.73
SCHEMBL6427665 0.73 ALDH1A1 (0.35)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8256884-B2 Ink jet ink and ink set E I DU PONT DE NEMOURS AND COMPANY (US) 2012-09-04 US claimed
US-20100255201-A1 INK JET INK AND INK SET E.I. DU PONT DE NEMOURS AND COMPANY (US) 2010-10-07 US claimed
WO-2009124157-A1 INK JET INK AND INK SET E. I. DU PONT DE NEMOURS AND COMPANY (US) 2009-10-08 WO claimed
US-20080166615-A1 COOLING LIQUID COMPOSITION FOR FUEL CELL SHISHIAI-KABUSHIKIGAISHA (JP) 2008-07-10 US claimed
US-20060145120-A1 Cooling liquid composition for fuel cell SHISHIAI-KABUSHIKIGAISHA (JP) 2006-07-06 US claimed
EP-1653544-A1 COOLING LIQUID COMPOSITION FOR FUEL CELL Shishiai-Kabushikigaisha (JP) 2006-05-03 EP claimed
CN-119972083-A For catalyzing CO2Cu for synthesizing cyclic carbonate from alkynol2O-supported ZIF-derived ZnCo catalyst and preparation method and application thereof 上海应用技术大学 2025-05-13 CN disclosed
CN-119972082-A For catalyzing CO2And Cu for synthesizing cyclic carbonate by substituting alkynol2O-supported ZnAl-LDH catalyst and preparation method and application thereof 上海应用技术大学 2025-05-13 CN disclosed
EP-4448675-A1 HEAT TRANSFER SYSTEM WITH ORGANIC, NON-IONIC INHIBITORS COMPATIBLE WITH FLUX EXPOSURE IN FUEL CELL OPERATIONS CCI North America Corporation (US) 2024-10-23 EP disclosed
US-12111574-B2 Resist composition, method of forming resist pattern, compound, and resin TOKYO OHKA KOGYO CO., LTD. (JP) 2024-10-08 US disclosed
WO-2023111687-A1 HEAT TRANSFER SYSTEM WITH ORGANIC, NON-IONIC INHIBITORS COMPATIBLE WITH FLUX EXPOSURE IN FUEL CELL OPERATIONS CCI HOLDINGS, INC. (JP) 2023-06-22 WO disclosed
US-11675268-B2 Composition for forming organic film, patterning process, and polymer SHIN-ETSU CHEMICAL CO., LTD. (JP) 2023-06-13 US disclosed
US-20220206385-A1 RESIST COMPOSITION, METHOD OF FORMING RESIST PATTERN, COMPOUND, AND RESIN TOKYO OHKA KOGYO CO., LTD. (JP) 2022-06-30 US disclosed
WO-2007134434-A1 PHENANTHRENE DERIVATIVES AS MPGES-1 INHIBITORS MERCK FROSST CANADA LTD. (CA) 2007-11-29 WO disclosed
US-20060145120-A1 Cooling liquid composition for fuel cell SHISHIAI-KABUSHIKIGAISHA (JP) 2006-07-06 US disclosed
EP-1653544-A1 COOLING LIQUID COMPOSITION FOR FUEL CELL Shishiai-Kabushikigaisha (JP) 2006-05-03 EP disclosed
US-4179561-A REACTING A 3-DIAZOOXINDOLE WITH A SUBSTITUTED ACETYLENE E. R. SQUIBB & SONS, INC. (US) 1979-12-18 US disclosed
US-4158672-A OIL AND WATER REPELLENTS FOR TEXTILES CIBA-GEIGY CORPORATION (US) 1979-06-19 US disclosed
US-4112096-A ANTIALLERGENS E. R. SQUIBB & SONS, INC. (US) 1978-09-05 US disclosed
US-4076818-A ANTIALLERGENS E. R. SQUIBB & SONS, INC. (US) 1978-02-28 US disclosed