SCHEMBL3053592

SCHEMBL3053592

CC(C)=CC=CC(N)=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
SCHEMBL6553350 0.90 ALDH1A1 (0.38)
SCHEMBL873403 0.77
SCHEMBL873402 0.77
SCHEMBL18459583 0.75 TDP1 (0.31)
SCHEMBL22549936 0.75 TDP1 (0.42)
SCHEMBL13464841 0.75 ALDH1A1 (0.44)
SCHEMBL21250221 0.75 ALDH1A1 (0.44)
SCHEMBL13464870 0.75 ALDH1A1 (0.44)
SCHEMBL13464676 0.75 ALDH1A1 (0.44)
SCHEMBL11456995 0.74

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108619095-A A kind of chitosan medical sterilization spray 宁波科瑞特动物药业有限公司 2018-10-09 CN disclosed
CN-108017578-A A kind of chloro- N of 2-, the preparation method of N- dimethyl nicotinamides 江苏丰山集团股份有限公司 2018-05-11 CN disclosed
US-20100279230-A1 PRODUCTION METHOD OF LITHOGRAPHIC PRINTING PLATE, LITHOGRAPHIC PRINTING PLATE PRECURSOR AND LITHOGRAPHIC PRINTING METHOD MITSUMOTO TOMOYOSHI 2010-11-04 US disclosed
US-7745090-B2 Imagewise exposing printing plate precursor comprising a support,image recording layer andprotective layer; rubbing the plate surface by an automatic rubbing processor in the presence of a non-alkaline developerto remove the protective layer and the image recording layer in the unexposed area FUJIFILM CORPORATION (JP) 2010-06-29 US disclosed
US-20060046199-A1 Imagewise exposing printing plate precursor comprising a support,image recording layer andprotective layer; rubbing the plate surface by an automatic rubbing processor in the presence of a non-alkaline developerto remove the protective layer and the image recording layer in the unexposed area FUJI PHOTO FILM CO., LTD. 2006-03-02 US disclosed