SCHEMBL3758951

SCHEMBL3758951

O=C(OCCOc1ccccc1Cl)C(=O)OCCOc1ccccc1Cl

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.60
KMT2A Q03164 3/20 0.60
PKM P14618 2/20 0.60
L3MBTL1 Q9Y468 4/20 0.53
HPGD P15428 4/20 0.51
MAPT P10636 3/20 0.51
ALDH1A1 P00352 3/20 0.51
TSHR P16473 2/20 0.51
MAPK1 P28482 2/20 0.51
SMN1; SMN2 Q16637 1/20 0.50
NPC1 O15118 4/20 0.49
RAB9A P51151 4/20 0.49
LMNA P02545 1/20 0.49
RXRA P19793 1/20 0.49
RXRB P28702 1/20 0.49
KCNH2 Q12809 1/20 0.49
TP53 P04637 1/20 0.49
HTT P42858 1/20 0.49
TDP1 Q9NUW8 1/20 0.47
ALOX15 P16050 1/20 0.46

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
SCHEMBL9860977 0.84 MEN1 (0.55) MEN1KMT2APKML3MBTL1HPGD
SCHEMBL9808263 0.84 L3MBTL1 (0.68) MEN1KMT2APKML3MBTL1HPGD
SCHEMBL9109274 0.82 THRB (0.62) MEN1KMT2APKML3MBTL1HPGD
SCHEMBL7991473 0.79 NPC1 (0.70) MEN1KMT2APKMALDH1A1TSHR
SCHEMBL8841071 0.78 MEN1 (0.49) MEN1KMT2APKML3MBTL1HPGD
SCHEMBL7015731 0.78 ALDH1A1 (0.49) MEN1KMT2APKML3MBTL1HPGD
SCHEMBL11881226 0.78 L3MBTL1 (0.79) MEN1KMT2APKML3MBTL1HPGD
SCHEMBL578719 0.78 LMNA (0.64) MEN1KMT2APKML3MBTL1HPGD
SCHEMBL4890428 0.77 MEN1 (0.55) MEN1KMT2APKML3MBTL1HPGD
SCHEMBL7995034 0.77 NPC1 (0.59) MEN1KMT2APKML3MBTL1HPGD

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-8978553-B2 Heat-sensitive lithographic printing plates MITSUBISHI PAPER MILLS LIMITED (JP) 2015-03-17 US disclosed
US-20120192740-A1 FOUNTAIN SOLUTION COMPOSITION FOR LITHOGRAPHIC PRINTING PLATE AND LITHOGRAPHIC PRINTING METHOD MITSUBISHI PAPER MILLS LIMITED (JP) 2012-08-02 US disclosed
US-20100307359-A1 HEAT-SENSITIVE LITHOGRAPHIC PRINTING PLATES MITSUBISHI PAPER MILLS LIMITED (JP) 2010-12-09 US disclosed