SCHEMBL279543

SCHEMBL279543

CCN(CC)c1cccc(C(=CC=CC(c2ccc(COCC3CO3)cc2)c2ccc(COCC3CO3)cc2)c2cccc(N(CC)CC)c2)c1

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.32
CYP3A4 P08684 1/20 0.32

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

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
SCHEMBL9607501 0.86 ALDH1A1 (0.37) ALDH1A1CYP3A4
SCHEMBL9439740 0.68 ALDH1A1 (0.42) ALDH1A1CYP3A4
SCHEMBL13813714 0.68 CNR2 (0.47) ALDH1A1
Iodide SCHEMBL8982997 0.67 ALDH1A1 (0.41) ALDH1A1CYP3A4
Bromide SCHEMBL8982786 0.67 CNR2 (0.46) ALDH1A1
SCHEMBL9608963 0.65 ALDH1A1 (0.46) ALDH1A1CYP3A4
SCHEMBL12111777 0.64 TDP1 (0.45) ALDH1A1
SCHEMBL13813713 0.64 ALDH1A1 (0.38) ALDH1A1
SCHEMBL13498625 0.64 ALDH1A1 (0.51) ALDH1A1CYP3A4
SCHEMBL14445085 0.64 TSHR (0.38) ALDH1A1CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8133645-B2 Method of manufacturing electrophotographic photoreceptor, electrophotographic photoreceptor, image-forming apparatus, and process cartridge FUJI XEROX CO., LTD. (JP) 2012-03-13 US disclosed
US-8133645-B2 Method of manufacturing electrophotographic photoreceptor, electrophotographic photoreceptor, image-forming apparatus, and process cartridge FUJI XEROX CO., LTD. (JP) 2012-03-13 US disclosed
US-20080299473-A1 METHOD OF MANUFACTURING ELECTROPHOTOGRAPHIC PHOTORECEPTOR, ELECTROPHOTOGRAPHIC PHOTORECEPTOR, IMAGE-FORMING APPARATUS, AND PROCESS CARTRIDGE FUJI XEROX CO., LTD. (JP) 2008-12-04 US disclosed
US-20080299473-A1 METHOD OF MANUFACTURING ELECTROPHOTOGRAPHIC PHOTORECEPTOR, ELECTROPHOTOGRAPHIC PHOTORECEPTOR, IMAGE-FORMING APPARATUS, AND PROCESS CARTRIDGE FUJI XEROX CO., LTD. (JP) 2008-12-04 US disclosed