SCHEMBL515343

SCHEMBL515343

CC(CO)c1ncc[nH]1

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
SCHEMBL9459934 1.00
SCHEMBL9460139 1.00
SCHEMBL28391810 0.81
SCHEMBL13066227 0.81
SCHEMBL3167804 0.81
SCHEMBL6953978 0.80 MMP1 (0.40)
Hydrochloric Acid SCHEMBL29074311 0.79 TXN (0.44)
SCHEMBL1696874 0.79
SCHEMBL5990737 0.79
SCHEMBL10556487 0.79

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12202926-B2 Polyurethane insulation foam composition comprising halogenated olefins and a tertiary amine compound HUNTSMAN INTERNATIONAL LLC 2025-01-21 US claimed
US-20230203232-A1 POLYURETHANE INSULATION FOAM COMPOSITION COMPRISING HALOGENATED OLEFINS AND A TERTIARY AMINE COMPOUND HUNTSMAN INTERNATIONAL LLC 2023-06-29 US claimed
US-11649315-B2 Polyurethane insulation foam composition comprising halogenated olefins and a tertiary amine compound HUNTSMAN INTERNATIONAL LLC (US) 2023-05-16 US claimed
US-20220340705-A1 POLYOL RESIN BLEND FOR USE IN PRODUCING STABLE POLYOL COMPONENTS HUNTSMAN PETROCHEMICAL LLC 2022-10-27 US claimed
EP-4038123-A1 POLYOL RESIN BLEND FOR USE IN PRODUCING STABLE POLYOL COMPONENTS Huntsman Petrochemical LLC (US) 2022-08-10 EP claimed
CN-114616262-A Polyol resin blends for producing stable polyol components 亨斯迈石油化学有限责任公司 2022-06-10 CN claimed
US-20210070917-A1 POLYURETHANE INSULATION FOAM COMPOSITION COMPRISING HALOGENATED OLEFINS AND A TERTIARY AMINE COMPOUND HUNTSMAN INTERNATIONAL LLC 2021-03-11 US claimed
US-20210061937-A1 POUR-IN-PLACE POLYURETHANE INSULATION FOAM COMPOSITION COMPRISING HALOGENATED OLEFINS HUNTSMAN INTERNATIONAL LLC 2021-03-04 US claimed
US-20210061938-A1 POLYURETHANE INSULATION FOAM COMPOSITION COMPRISING HALOGENATED OLEFINS HUNTSMAN INTERNATIONAL LLC 2021-03-04 US claimed
EP-3681631-A1 POLYURETHANE INSULATION FOAM COMPOSITION COMPRISING HALOGENATED OLEFINS Huntsman International LLC (US) 2020-07-22 EP claimed
CN-111132760-A Halogenated olefin-containing polyurethane thermal insulation foam composition 亨斯迈国际有限责任公司 2020-05-08 CN claimed
CN-111093825-A Halogenated olefin-containing pour-in-place polyurethane insulation foam composition 亨斯迈国际有限责任公司 2020-05-01 CN claimed
CN-111093826-A Polyurethane thermal insulation foam composition containing halogenated olefin and tertiary amine compound 亨斯迈国际有限责任公司 2020-05-01 CN claimed
WO-2019055441-A1 POLYURETHANE INSULATION FOAM COMPOSITION COMPRISING HALOGENATED OLEFINS AND A TERTIARY AMINE COMPOUND HUNTSMAN INTERNATIONAL LLC (US) 2019-03-21 WO claimed
WO-2019055401-A1 POLYURETHANE INSULATION FOAM COMPOSITION COMPRISING HALOGENATED OLEFINS HUNTSMAN INTERNATIONAL LLC (US) 2019-03-21 WO claimed
EP-2106415-B1 TERTIARY AMINES BLOCKED WITH POLYMER ACIDS HUNTSMAN PETROCHEMICAL LLC (US) 2016-04-20 EP claimed
US-20100099785-A1 TERTIARY AMINES BLOCKED WITH POLYMER ACIDS HUNTSMAN PETROCHEMICAL CORPORATION (US) 2010-04-22 US claimed
EP-2106415-A1 TERTIARY AMINES BLOCKED WITH POLYMER ACIDS Huntsman Petrochemical Corporation (US) 2009-10-07 EP claimed
WO-2008089411-A1 TERTIARY AMINES BLOCKED WITH POLYMER ACIDS HUNTSMAN PETROCHEMICAL CORPORATION (US) 2008-07-24 WO claimed
US-5870275-A CONTAINING A QUATERNARY AMIDINE GROUP SANYO CHEMICAL INDUSTRIES, LTD. (JP) 1999-02-09 US claimed