SCHEMBL8639385

SCHEMBL8639385

O=c1c2cc(F)c(O)c(F)c2oc2c(F)c(O)c(F)cc12

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ATP1A1 P05023 2/20 0.42
ATP1B1 P05026 2/20 0.42
ATP1A3 P13637 2/20 0.42
ATP1B2 P14415 2/20 0.42
ATP1A2 P50993 2/20 0.42
ATP1B3 P54709 2/20 0.42
FXYD2 P54710 2/20 0.42
ATP1A4 Q13733 2/20 0.42
NUDT1 P36639 1/20 0.42
ESR1 P03372 2/20 0.40
ESR2 Q92731 2/20 0.40
BACE1 P56817 3/20 0.37
GSR P00390 2/20 0.37
GSTP1 P09211 2/20 0.37
TXNRD1 Q16881 2/20 0.37
TXNRD3 Q86VQ6 2/20 0.37
TXNRD2 Q9NNW7 2/20 0.37
MET P08581 2/20 0.37
KDM4E B2RXH2 1/20 0.37
MEN1 O00255 1/20 0.37

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
SCHEMBL8571050 0.79 MET (0.51) ESR1ESR2BACE1GSRGSTP1
SCHEMBL13177605 0.78 KDM4E (0.48) ESR1ESR2BACE1GSRGSTP1
SCHEMBL565580 0.77 MCL1 (0.55) KDM4EMEN1CA12LMNATP53
SCHEMBL29391372 0.77 MCL1 (0.55) KDM4EMEN1CA12LMNATP53
SCHEMBL22702331 0.74 KDM4E (0.41) ESR1ESR2BACE1GSRGSTP1
SCHEMBL8570582 0.74 CSNK2A2 (0.51) ESR1ESR2METKDM4EMEN1
SCHEMBL17716549 0.73 KDM4E (0.66) ESR1ESR2BACE1GSRGSTP1
SCHEMBL669385 0.73 MCL1 (0.56) ESR1ESR2METKDM4EGAA
SCHEMBL7230275 0.72 ATP1A1 (0.57) ATP1A1ATP1B1ATP1A3ATP1B2ATP1A2
Phosphoric Acid SCHEMBL1934555 0.72 MCL1 (0.50) KDM4EMEN1CA12LMNATP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0664014-B1 NLO SIDE CHAIN POLYMERS HAVING LOW OPTICAL LOSS AKZO NOBEL NV (NL) 1998-08-19 EP disclosed
EP-0824096-A2 Process for the preparation of halogenated (meth)acrylic esters and poly (meth) arcylates obtained with said (meth)acrylic esters Akzo Nobel N.V. (NL) 1998-02-18 EP disclosed
EP-0664014-A1 NLO SIDE CHAIN POLYMERS HAVING LOW OPTICAL LOSS Akzo Nobel N.V. (NL) 1995-07-26 EP disclosed
WO-1994008269-A1 NLO SIDE CHAIN POLYMERS HAVING LOW OPTICAL LOSS AKZO NOBEL N.V. (NL) 1994-04-14 WO disclosed