SCHEMBL2497942

SCHEMBL2497942

CCC/C(NC(C)N)=C(/C)C(=O)O

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FNTA P49354 2/20 0.35
FNTB P49356 2/20 0.35
THRB P10828 1/20 0.35
PGGT1B P53609 1/20 0.35
HDAC3 O15379 2/20 0.34
HDAC1 Q13547 2/20 0.34
HDAC2 Q92769 2/20 0.34
HDAC8 Q9BY41 2/20 0.34
HDAC6 Q9UBN7 1/20 0.34
FFAR3 O14843 1/20 0.33
CTSD P07339 1/20 0.33
GABRP O00591 2/20 0.32
GABRD O14764 2/20 0.32
GABRA1 P14867 2/20 0.32
GABRB1 P18505 2/20 0.32
GABRG2 P18507 2/20 0.32
GABRB3 P28472 2/20 0.32
GABRA5 P31644 2/20 0.32
GABRA3 P34903 2/20 0.32
GABRA2 P47869 2/20 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
SCHEMBL18229223 0.80 POLB (0.41) FNTAFNTBTHRBPGGT1BHDAC3
SCHEMBL641328 0.74 CYP2C19 (0.47) FNTAFNTBTHRBPGGT1BHDAC3
SCHEMBL1053072 0.74 HDAC3 (0.41) FNTAFNTBTHRBPGGT1BHDAC3
SCHEMBL2189435 0.73 CRBN (0.39) FNTAFNTBTHRBPGGT1BHDAC3
SCHEMBL8507231 0.72 FNTA (0.39) FNTAFNTBTHRBPGGT1BHDAC3
SCHEMBL10885615 0.72 MEN1 (0.40) HDAC3HDAC1HDAC2HDAC8HDAC6
SCHEMBL8601955 0.72 MEN1 (0.40) HDAC3HDAC1HDAC2HDAC8HDAC6
SCHEMBL3439462 0.71
SCHEMBL1143033 0.69 FNTA (0.37) FNTAFNTBTHRBPGGT1BHDAC3
Ethylamine SCHEMBL28030590 0.69 CYP2D6 (0.37) GABRPGABRDGABRA1GABRB1GABRG2

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-8029961-B2 Toner for developing latent electrostatic image, method for producing the same and apparatus for producing the same, and developer, toner container, process cartridge, image forming method and image forming apparatus RICOH COMPANY, LTD. (JP) 2011-10-04 US disclosed
US-20090170018-A1 TONER FOR DEVELOPING LATENT ELECTROSTATIC IMAGE, METHOD FOR PRODUCING THE SAME AND APPARATUS FOR PRODUCING THE SAME, AND DEVELOPER, TONER CONTAINER, PROCESS CARTRIDGE, IMAGE FORMING METHOD AND IMAGE FORMING APPARATUS RICOH COMPANY, LTD. (JP) 2009-07-02 US disclosed
EP-1186638-B1 Use of a printing ink, printing method and printed packaging material TOYO SEIKAN KAISHA LTD (JP) 2006-06-07 EP disclosed
EP-1186638-A1 Printing ink, printing method and printed packaging material TOYO SEIKAN KAISHA LIMITED (JP) 2002-03-13 EP disclosed