SCHEMBL2495440

SCHEMBL2495440

C=C(CCCNCCN)C(=O)O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 5/20 0.44
CA6 P23280 5/20 0.44
CA7 P43166 5/20 0.44
CA9 Q16790 5/20 0.44
CA14 Q9ULX7 5/20 0.44
CA5B Q9Y2D0 5/20 0.44
CA2 P00918 4/20 0.44
CA4 P22748 4/20 0.44
CA5A P35218 4/20 0.44
CA3 P07451 3/20 0.44
MEN1 O00255 2/20 0.42
RECQL P46063 2/20 0.42
KMT2A Q03164 2/20 0.42
PAOX Q6QHF9 1/20 0.41
ALOX15 P16050 3/20 0.40
LMNA P02545 2/20 0.40
TDP1 Q9NUW8 2/20 0.40
ALDH1A1 P00352 2/20 0.40
CA1 P00915 2/20 0.40
TP53 P04637 1/20 0.40

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
SCHEMBL2497943 0.94 PAOX (0.48) CA12CA6CA7CA9CA14
SCHEMBL14480411 0.86 PAOX (0.42) CA12CA6CA7CA9CA14
SCHEMBL3140244 0.85 LMNA (0.42) KMT2AALOX15LMNAALDH1A1HDAC6
SCHEMBL819365 0.83 CAMK2A (0.36) PAOXALOX15KDM4EHSD17B10
SCHEMBL5086079 0.83 KDM4E (0.37) MEN1KMT2APAOXALOX15LMNA
SCHEMBL246135 0.82 ALOX15 (0.45) MEN1KMT2APAOXALOX15ALDH1A1
SCHEMBL636292 0.82 PAOX (0.47) PAOXALOX15ALDH1A1CYP1A2CYP2C19
SCHEMBL7779000 0.81 ALOX15 (0.34) ALOX15HSD17B10
Itaconate SCHEMBL11873917 0.81 ALOX15 (0.54) CA12CA6CA7CA9CA14
SCHEMBL4276362 0.80 ALDH1A1 (0.50) PAOXALOX15ALDH1A1CASP2TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8299190-B2 Colored polymer particles, method for producing the same, and toner and developer using the same NATIONAL UNIVERSITY CORPORATION SHIZUOKA UNIVERSITY (JP) 2012-10-30 US disclosed
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
US-20090162770-A1 COLORED POLYMER PARTICLES, METHOD FOR PRODUCING THE SAME, AND TONER AND DEVELOPER USING THE SAME RICOH COMPANY, LTD. (JP) 2009-06-25 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