SCHEMBL5698842

SCHEMBL5698842

O=C(O)c1ccc2cc(OC(=O)c3ccc4cc(C(=O)O)ccc4c3)ccc2c1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.65
KMT2A Q03164 6/20 0.62
MAPT P10636 2/20 0.62
MEN1 O00255 2/20 0.62
TDP1 Q9NUW8 1/20 0.62
HGFAC Q04756 2/20 0.52
TMPRSS2 O15393 1/20 0.50
MLNR O43193 1/20 0.50
ALDH1A1 P00352 1/20 0.50
F2 P00734 1/20 0.50
C1R P00736 1/20 0.50
F10 P00742 1/20 0.50
PLG P00747 1/20 0.50
F12 P00748 1/20 0.50
LMNA P02545 1/20 0.50
ITGB3 P05106 1/20 0.50
HPN P05981 1/20 0.50
KLK1 P06870 1/20 0.50
PRSS1 P07477 1/20 0.50
CHRM2 P08172 1/20 0.50

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
SCHEMBL6052888 0.96 KMT2A (0.68) KDM4EKMT2AMAPTMEN1TDP1
SCHEMBL5698841 0.94 KMT2A (0.66) KDM4EKMT2AMAPTMEN1TDP1
SCHEMBL9944054 0.92 KMT2A (0.59) KDM4EKMT2AMAPTMEN1TDP1
SCHEMBL10778099 0.91 KMT2A (0.77) KDM4EKMT2AMAPTMEN1TDP1
SCHEMBL12268536 0.90 KDM4E (0.58) KDM4EKMT2AMAPTMEN1TDP1
SCHEMBL9793342 0.90 KMT2A (0.60) KDM4EKMT2AMAPTMEN1TDP1
Ethylene Glycol SCHEMBL7530947 0.88 KMT2A (0.58) KDM4EKMT2AMAPTMEN1TDP1
SCHEMBL4138214 0.88 KMT2A (0.54) KDM4EKMT2AMAPTMEN1TDP1
SCHEMBL6052916 0.88 KMT2A (0.58) KDM4EKMT2AMAPTMEN1TDP1
SCHEMBL29637878 0.87 MAPT (0.57) KDM4EKMT2AMAPTMEN1TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1462468-B1 LIQUID-CRYSTAL POLYESTER RESIN UENO SEIYAKU OYO KENKYUJO KK (JP) 2006-08-02 EP disclosed
EP-1422256-B1 THERMOTROPIC LIQUID-CRYSTAL POLYMER UENO SEIYAKU OYO KENKYUJO KK (JP) 2006-08-02 EP disclosed