SCHEMBL10033437

SCHEMBL10033437

CC(=O)CC(=O)NCCNC(=O)CC(=O)O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PHF8 Q9UPP1 5/20 0.46
KDM2A Q9Y2K7 5/20 0.46
KDM4E B2RXH2 4/20 0.46
KDM5C P41229 3/20 0.46
EGLN1 Q9GZT9 3/20 0.46
KDM6B O15054 2/20 0.46
LMNA P02545 2/20 0.42
SLC15A2 Q16348 1/20 0.42
ECE1 P42892 1/20 0.41
LDHA P00338 1/20 0.38
SRR Q9GZT4 1/20 0.38
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
ALDH1A1 P00352 1/20 0.37
ADRA1A P35348 2/20 0.36
MGAM O43451 1/20 0.35
GAA P10253 1/20 0.35
SI P14410 1/20 0.35
MGAM2 Q2M2H8 1/20 0.35
MAPT P10636 1/20 0.34

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
SCHEMBL4453310 0.89 MEN1 (0.43) PHF8KDM2AKDM4EKDM5CEGLN1
SCHEMBL12036660 0.87 LDHA (0.50) PHF8KDM2AKDM4EKDM5CEGLN1
SCHEMBL10033458 0.85 KDM4E (0.50) KDM4ELMNASLC15A2ECE1LDHA
SCHEMBL17502758 0.85 KDM4E (0.41) PHF8KDM2AKDM4EKDM5CEGLN1
SCHEMBL18174484 0.85 KDM4E (0.41) PHF8KDM2AKDM4EKDM5CEGLN1
SCHEMBL2561173 0.83 ECE1 (0.61) PHF8KDM2AKDM4EKDM5CEGLN1
SCHEMBL12799430 0.82 KDM4E (0.52) PHF8KDM2AKDM4EKDM5CEGLN1
SCHEMBL16687527 0.80 ECE1 (0.41) PHF8KDM2AKDM4EKDM5CEGLN1
SCHEMBL2553506 0.79 ADRA1A (0.55) PHF8KDM2AKDM4EKDM5CEGLN1
SCHEMBL10603233 0.77 MCL1 (0.52) LMNAMEN1KMT2AALDH1A1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8702223-B2 Infrared-absorbing radiation-curable inks XEROX CORPORATION (US) 2014-04-22 US disclosed
US-20120162333-A1 Infrared-Absorbing Radiation-Curable Inks XEROX CORPORATION (US) 2012-06-28 US disclosed
US-7887176-B2 High image quality in inkjet printing onto flexible packaging substrates of polyester, polypropylene, and aluminum foil, can be significantly improved by the use of radiation curable gel based phase change inks; not requiring pinning of the ink during color printing or nitrogen inerting during curing XEROX CORPORATION (US) 2011-02-15 US disclosed