SCHEMBL3922641

SCHEMBL3922641

CCCC(CC)CC(O)CO

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.44
LMNA P02545 4/20 0.43
TSHR P16473 1/20 0.39
THRB P10828 1/20 0.36
USP2 O75604 2/20 0.32
CYP3A4 P08684 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
FDPS P14324 1/20 0.31
TRPA1 O75762 1/20 0.31
TDP1 Q9NUW8 1/20 0.30

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
SCHEMBL27678371 0.86 ALDH1A1 (0.64) ALDH1A1LMNATSHRUSP2CYP3A4
SCHEMBL2388866 0.86 ALDH1A1 (0.64) ALDH1A1LMNATSHRUSP2CYP3A4
SCHEMBL20298367 0.85 ALDH1A1 (0.37) ALDH1A1LMNATSHRCYP3A4TDP1
SCHEMBL20298427 0.85 ALDH1A1 (0.37) ALDH1A1LMNATSHRCYP3A4TDP1
SCHEMBL27998944 0.85 LMNA (0.44) ALDH1A1LMNATSHRTHRBUSP2
SCHEMBL16949688 0.85 LMNA (0.44) ALDH1A1LMNATSHRTHRBUSP2
SCHEMBL30525900 0.85 ALDH1A1 (0.56) ALDH1A1LMNATSHRUSP2CYP3A4
SCHEMBL28319044 0.83 LMNA (0.59) ALDH1A1LMNAUSP2CYP3A4
SCHEMBL28112894 0.83 LMNA (0.59) ALDH1A1LMNAUSP2CYP3A4
SCHEMBL6700273 0.82 ALDH1A1 (0.44) ALDH1A1LMNATSHRTHRBUSP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2042339-B1 Fountain solution composition for lithographic printing and heatset offset rotary printing process FUJIFILM CORP (JP) 2013-05-22 EP disclosed
US-20090242829-A1 Heat transfer fluids for low temperature application comprising aromatic hydrocarbons DAVIDSON DAVID LEE 2009-10-01 US disclosed
US-20090226616-A1 FOUNTAIN SOLUTION COMPOSITION FOR LITHOGRAPHIC PRINTING AND HEAT-SET OFFSET ROTARY PRINTING PROCESS FUJIFILM CORPORATION (JP) 2009-09-10 US disclosed
US-20090226616-A1 FOUNTAIN SOLUTION COMPOSITION FOR LITHOGRAPHIC PRINTING AND HEAT-SET OFFSET ROTARY PRINTING PROCESS FUJIFILM CORPORATION (JP) 2009-09-10 US disclosed
EP-2098377-A2 Fountain solution composition for lithographic printing and heat-set offset rotary printing process FUJIFILM Corporation (JP) 2009-09-09 EP disclosed
EP-2042339-A2 Fountain solution composition for lithographic printing and heatset offset rotary printing process Fujifilm Corporation (JP) 2009-04-01 EP disclosed
US-20090078140-A1 FOUNTAIN SOLUTION COMPOSITION FOR LITHOGRAPHIC PRINTING AND HEAT-SET OFFSET ROTARY PRINTING PROCESS FUJIFILM CORPORATION (JP) 2009-03-26 US disclosed
US-20090078140-A1 FOUNTAIN SOLUTION COMPOSITION FOR LITHOGRAPHIC PRINTING AND HEAT-SET OFFSET ROTARY PRINTING PROCESS FUJIFILM CORPORATION (JP) 2009-03-26 US disclosed
US-20080011979-A1 Heat Transfer Fluids for Application Over a Broad Range of Temperatures SOLUTIA INC. 2008-01-17 US disclosed
EP-1702019-A1 HEAT TRANSFER FLUIDS FOR LOW TEMPERATURE APPLICATION COMPRISING AROMATIC HYDROCARBONS Solutia Europe N.V./S.A. (BE) 2006-09-20 EP disclosed
EP-1563034-A1 HEAT TRANSFER FLUIDS FOR APPLICATION OVER A BROAD RANGE OF TEMPERATURES NV Solutia Europe S.A. (BE) 2005-08-17 EP disclosed
WO-2005054401-A1 HEAT TRANSFER FLUIDS FOR LOW TEMPERATURE APPLICATION COMPRISING AROMATIC HYDROCARBONS SOLUTIA EUROPE N.V./S.A. (BE) 2005-06-16 WO disclosed
EP-1538189-A1 Heat transfer fluids for low temperature application comprising aromatic hydrocarbons Solutia Europe N.V./S.A. (BE) 2005-06-08 EP disclosed
WO-2004041958-A1 HEAT TRANSFER FLUIDS FOR APPLICATION OVER A BROAD RANGE OF TEMPERATURES N.V. SOLUTIA EUROPE S.A. (BE) 2004-05-21 WO disclosed
EP-1418216-A1 Heat transfer fluids for application over a broad range of temperatures N.V. Solutia S.A. (BE) 2004-05-12 EP disclosed