SCHEMBL9925427

SCHEMBL9925427

C=CC(=O)NCC(=O)CC(C)=O

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.50
ALDH1A1 P00352 3/20 0.50
MAPK1 P28482 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
ZDHHC20 Q5W0Z9 1/20 0.42
ZDHHC2 Q9UIJ5 1/20 0.42
KDM4E B2RXH2 1/20 0.37
KDM6B O15054 1/20 0.37
KDM5C P41229 1/20 0.37
EGLN1 Q9GZT9 1/20 0.37
PHF8 Q9UPP1 1/20 0.37
KDM2A Q9Y2K7 1/20 0.37
TGM2 P21980 4/20 0.35
HTT P42858 1/20 0.33
PSMB5 P28074 1/20 0.32
GAA P10253 2/20 0.31
MGAM O43451 1/20 0.31
SI P14410 1/20 0.31
MGAM2 Q2M2H8 1/20 0.31

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
SCHEMBL8219002 0.84
SCHEMBL9811823 0.80 ALDH1A1 (0.52) TSHRALDH1A1MAPK1TDP1ZDHHC20
Acetone SCHEMBL9190129 0.79 ALDH1A1 (0.56) TSHRALDH1A1MAPK1TDP1ZDHHC20
SCHEMBL15365085 0.79
SCHEMBL296003 0.79 ZDHHC20 (0.48) TSHRALDH1A1MAPK1TDP1ZDHHC20
SCHEMBL19371288 0.77
Acetic Acid SCHEMBL4650595 0.77 ALDH1A1 (0.54) TSHRALDH1A1MAPK1TDP1ZDHHC20
SCHEMBL12849273 0.77 TSHR (0.48) TSHRALDH1A1MAPK1TDP1ZDHHC20
Ethane SCHEMBL9809196 0.77
Methyl Alcohol SCHEMBL8855368 0.77

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8642247-B2 Ink composition, inkjet recording method, printed material, method for producing planographic printing plate, and planographic printing plate FUJIFILM CORPORATION (JP) 2014-02-04 US disclosed
US-8211623-B2 Ink composition, inkjet recording method, printed material, method for producing planographic printing plate, and planographic printing plate FUJIFILM CORPORATION (JP) 2012-07-03 US disclosed
US-8211623-B2 Ink composition, inkjet recording method, printed material, method for producing planographic printing plate, and planographic printing plate FUJIFILM CORPORATION (JP) 2012-07-03 US disclosed
US-20120149797-A1 INK COMPOSITION, INKJET RECORDING METHOD, PRINTED MATERIAL, METHOD FOR PRODUCING PLANOGRAPHIC PRINTING PLATE, AND PLANOGRAPHIC PRINTING PLATE FUJIFILM CORPORATION (JP) 2012-06-14 US disclosed
US-20100298494-A1 INK COMPOSITION, INKJET RECORDING METHOD, PRINTED MATERIAL, METHOD FOR PRODUCING PLANOGRAPHIC PRINTING PLATE, AND PLANOGRAPHIC PRINTING PLATE FUJIFILM CORPORATION (JP) 2010-11-25 US disclosed
US-20100298494-A1 INK COMPOSITION, INKJET RECORDING METHOD, PRINTED MATERIAL, METHOD FOR PRODUCING PLANOGRAPHIC PRINTING PLATE, AND PLANOGRAPHIC PRINTING PLATE FUJIFILM CORPORATION (JP) 2010-11-25 US disclosed
US-7794918-B2 Ink composition, inkjet recording method, printed material, method for producing planographic printing plate, and planographic printing plate FUJIFILM CORPORATION (JP) 2010-09-14 US disclosed
US-7794918-B2 Ink composition, inkjet recording method, printed material, method for producing planographic printing plate, and planographic printing plate FUJIFILM CORPORATION (JP) 2010-09-14 US disclosed
EP-1803784-A2 Ink composition, inkjet recording method, printed material, method for producing planographic printing plate, and planographic printing plate Fujifilm Corporation (JP) 2007-07-04 EP disclosed
US-20070146430-A1 Ink composition, inkjet recording method, printed material, method for producing planographic printing plate, and planographic printing plate FUJIFILM CORPORATION (JP) 2007-06-28 US disclosed
US-20070146430-A1 Ink composition, inkjet recording method, printed material, method for producing planographic printing plate, and planographic printing plate FUJIFILM CORPORATION (JP) 2007-06-28 US disclosed
EP-0345573-A2 2-[(Meth)acrylamidomethyl]-1,3-diketones BASF Aktiengesellschaft (DE) 1989-12-13 EP disclosed
EP-0345636-A2 Light-sensitive negative lithographic printing plates BASF Aktiengesellschaft (DE) 1989-12-13 EP disclosed