SCHEMBL628047

SCHEMBL628047

C=C(C)C(=O)OC.C=CC(=O)OCCOc1ccccc1

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.74
RAB9A P51151 5/20 0.47
MAPT P10636 1/20 0.47
SMN1; SMN2 Q16637 5/20 0.46
NPC1 O15118 4/20 0.46
TSHR P16473 1/20 0.46
MTNR1A P48039 1/20 0.44
MTNR1B P49286 1/20 0.44
TDP1 Q9NUW8 2/20 0.44
POLB P06746 2/20 0.44
LMNA P02545 2/20 0.44
TP53 P04637 1/20 0.44
APEX1 P27695 1/20 0.44
HTT P42858 1/20 0.44
L3MBTL1 Q9Y468 2/20 0.43
KDM4E B2RXH2 3/20 0.42
ALDH1A1 P00352 3/20 0.41
PKM P14618 1/20 0.41
MEN1 O00255 4/20 0.41
KMT2A Q03164 4/20 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
Acrylic Acid Ethyl Ester SCHEMBL629195 0.95 THRB (0.67) THRBRAB9AMAPTSMN1; SMN2NPC1
Styrene SCHEMBL629118 0.94 THRB (0.65) THRBRAB9AMAPTSMN1; SMN2NPC1
SCHEMBL7198333 0.92 THRB (0.78) THRBRAB9AMAPTSMN1; SMN2NPC1
Acrylic Acid Methyl Ester SCHEMBL28085444 0.90 THRB (0.65) THRBRAB9AMAPTSMN1; SMN2NPC1
Methacrylic Acid SCHEMBL20875123 0.89 THRB (0.82) THRBRAB9AMAPTSMN1; SMN2NPC1
SCHEMBL10706997 0.88 THRB (0.72) THRBRAB9AMAPTSMN1; SMN2NPC1
SCHEMBL4736172 0.88 THRB (0.67) THRBRAB9AMAPTSMN1; SMN2NPC1
Acrylic Acid Methyl Ester SCHEMBL27992751 0.88 THRB (0.85) THRBRAB9AMAPTSMN1; SMN2NPC1
SCHEMBL15936108 0.88 POLB (0.56) THRBRAB9AMAPTSMN1; SMN2NPC1
SCHEMBL28869327 0.87 THRB (0.70) THRBRAB9AMAPTSMN1; SMN2NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2042325-B1 Image forming method and apparatus FUJIFILM CORP (JP) 2012-02-22 EP disclosed
EP-2123461-B1 Image forming method FUJIFILM CORP (JP) 2011-04-20 EP disclosed
EP-2123462-B1 Inkjet recording method and apparatus FUJIFILM CORP (JP) 2011-04-13 EP disclosed
EP-2283070-A1 A CURABLE COMPOSITION AND USE THEREOF Henkel Corporation (US) 2011-02-16 EP disclosed
WO-2009137954-A1 A CURABLE COMPOSITION AND USE THEREOF NATIONAL STARCH AND CHEMICAL INVESTMENT HOLDING CORPORATION (US) 2009-11-19 WO disclosed