SCHEMBL8037145

SCHEMBL8037145

O=C=NCC1CCC2C3CCC(C3)C12

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
SCHEMBL1900904 0.81
SCHEMBL1901687 0.81
SCHEMBL8512400 0.75 TSHR (0.32)
SCHEMBL2330759 0.74
SCHEMBL19021594 0.74
SCHEMBL5013453 0.73 ALDH1A1 (0.31)
SCHEMBL31293680 0.72
SCHEMBL95678 0.72
SCHEMBL11026717 0.71
SCHEMBL19107425 0.70

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113088184-B High temperature resistant powder coating compositions and articles 威士伯涂料(上海)有限公司 2022-07-22 CN disclosed
CN-113088184-A High temperature resistant powder coating composition and article 威士伯涂料(上海)有限公司 2021-07-09 CN disclosed
EP-3762452-A1 NEW POLYISOCYANATE COMPOSITIONS Vencorex France (FR) 2021-01-13 EP disclosed
WO-2019170674-A1 NEW POLYISOCYANATE COMPOSITIONS VENCOREX FRANCE (FR) 2019-09-12 WO disclosed
EP-0986595-A1 COATING AGENT, METHOD FOR ITS PRODUCTION AND ITS USE AS COATING LACQUER OR TRANSPARENT LACQUER, IN PARTICULAR FOR COATING PLASTICS BASF Coatings AG (DE) 2000-03-22 EP disclosed
WO-1998055526-A1 COATING AGENT, METHOD FOR ITS PRODUCTION AND ITS USE AS COATING LACQUER OR TRANSPARENT LACQUER, IN PARTICULAR FOR COATING PLASTICS BASF COATINGS AG (DE) 1998-12-10 WO disclosed
EP-0462287-B1 POLYMER COMPOSITION, AQUEOUS DISPERSION PREPARED BY USING THE SAME AS EMULSIFIER, AND WATER-BASE COATING COMPOSITION NIPPON PAINT CO LTD (JP) 1996-11-13 EP disclosed
EP-0157291-B1 AQUEOUS POLYESTER-BASED DISPERSION, PROCESS FOR ITS PREPARATION AND ITS USE IN PREPARING STOVING ENAMELS BAYER AG (DE) 1989-07-19 EP disclosed