SCHEMBL10458191

SCHEMBL10458191

CCCC(O)(CCC)C(=O)c1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 3/20 0.53
ALOX12 P18054 1/20 0.53
CYP2C19 P33261 1/20 0.53
SRC P12931 1/20 0.47
CES1 P23141 8/20 0.47
CES2 O00748 5/20 0.46
ALDH1A1 P00352 2/20 0.45
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
KDM4E B2RXH2 1/20 0.45
CYP3A4 P08684 1/20 0.45
MAPT P10636 1/20 0.45
HPGD P15428 1/20 0.45
ALOX15 P16050 1/20 0.45
MAPK1 P28482 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
LMNA P02545 2/20 0.44
HTT P42858 1/20 0.44
NPC1 O15118 1/20 0.41

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
SCHEMBL6932937 0.89 GAA (0.50) GAAALOX12CYP2C19SRCCES1
SCHEMBL12064047 0.87 GAA (0.56) GAASRCCES1CES2ALDH1A1
SCHEMBL10471882 0.84 SRC (0.47) GAAALOX12CYP2C19SRCCES1
SCHEMBL4556750 0.83 CES1 (0.50) CYP2C19SRCCES1CES2ALDH1A1
SCHEMBL10943699 0.83 ALDH1A1 (0.50) GAACES1CES2ALDH1A1KMT2A
SCHEMBL9617688 0.82 SRC (0.46) GAAALOX12CYP2C19SRCCES1
SCHEMBL6692640 0.82 GAA (0.48) GAAALOX12CYP2C19SRCCES1
SCHEMBL452703 0.81 CES1 (0.49) GAAALOX12CYP2C19SRCCES1
SCHEMBL6698931 0.80 GAA (0.54) GAAALOX12CYP2C19SRCCES1
SCHEMBL9821868 0.80 GAA (0.47) GAAALOX12CYP2C19SRCCES1

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
EP-3181227-A1 POLYMERIC FUNCTIONAL MEMBRANE FOR REMOVING NITRATE IONS, PRODUCTION METHOD THEREFOR, SEPARATION MEMBRANE MODULE, AND ION EXCHANGE DEVICE Fujifilm Corporation (JP) 2017-06-21 EP disclosed
US-4902725-A Photocurable acrylic coating composition GENERAL ELECTRIC COMPANY (US) 1990-02-20 US disclosed
EP-0274595-A2 Aromatic carbonate resin articles coated with a photocured acrylic coating GENERAL ELECTRIC COMPANY (US) 1988-07-20 EP disclosed