SCHEMBL11953508

SCHEMBL11953508

C=C/C=C\C=C/NC

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
SCHEMBL16774013 1.00
SCHEMBL2787056 0.87
SCHEMBL15935811 0.87
SCHEMBL13186766 0.71
SCHEMBL18383122 0.71
SCHEMBL2833674 0.71 TRPA1 (0.33)
SCHEMBL730600 0.71 TRPA1 (0.33)
SCHEMBL730599 0.71 TRPA1 (0.33)
SCHEMBL2833644 0.71 TRPA1 (0.33)
SCHEMBL5420270 0.71

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 13 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023152349-A1 IRAK4 INHIBITORS ASTRAZENECA AB (SE) 2023-08-17 WO disclosed
EP-3883345-A1 FILM PRODUCTION METHOD Sumitomo Chemical Company Limited (JP) 2021-09-22 EP disclosed
EP-2375278-B1 COMPOSITION FOR FORMING LIQUID CRYSTAL ALIGNMENT FILM SHARP KK (JP) 2020-04-08 EP disclosed
US-9969715-B2 Compounds useful for treating cancer ABIVAX (FR) 2018-05-15 US disclosed
US-9871208-B2 Condensed cyclic compound and organic light-emitting device including the same SAMSUNG DISPLAY CO., LTD. (KR) 2018-01-16 US disclosed
US-20170275272-A1 6-HYDROXY-4-OXO-1,4-DIHYDROPYRIMIDINE-5-CARBOXAMIDES AS APJ AGONISTS BRISTOL-MYERS SQUIBB COMPANY 2017-09-28 US disclosed
US-20170229710-A1 ANODE ELECTRODE MATERIAL AND LITHIUM ION BATTERY USING THE SAME JIANGSU HUADONG INSTITUTE OF LI-ION BATTERY CO., LTD. (CN) 2017-08-10 US disclosed
EP-2657214-B1 PROCESS FOR PRODUCTION OF AROMATIC ALCOHOL OR HETEROCYCLIC AROMATIC ALCOHOL MITSUBISHI GAS CHEMICAL CO (JP) 2017-02-15 EP disclosed
US-9564601-B2 Condensed-cyclic compound and organic light-emitting device including the same SAMSUNG DISPLAY CO., LTD. (KR) 2017-02-07 US disclosed
US-8232265-B2 Multi-functional ionic liquid compositions for overcoming polymorphism and imparting improved properties for active pharmaceutical, biological, nutritional, and energetic ingredients BOARD OF TRUSTEES OF THE UNIVERSITY OF ALABAMA (US) 2012-07-31 US disclosed
EP-2030779-A1 THIN FILM AND THIN FILM LAMINATE USING THE SAME Tomoegawa Co., Ltd. (JP) 2009-03-04 EP disclosed
EP-1854638-A1 Reversible thermosensitive coloring material and reversible thermosensitive recording material using the same Ricoh Company, Ltd. (JP) 2007-11-14 EP disclosed
US-20070093462-A1 Multi-functional ionic liquid compositions for overcoming polymorphism and imparting improved properties for active pharmaceutical, biological, nutritional, and energetic ingredients BOARD OF TRUSTEES OF THE UNIVERSITY OF ALABAMA 2007-04-26 US disclosed