SCHEMBL13664624

SCHEMBL13664624

C=CC(=O)OCOc1ccc(C(=O)Oc2ccc(OC(=O)c3ccc(OCOC(=O)C=C)c(F)c3)c(C(F)(F)F)c2C(F)(F)F)cc1F

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.32
L3MBTL1 Q9Y468 2/20 0.32
KDM4E B2RXH2 1/20 0.32
TSHR P16473 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
LMNA P02545 1/20 0.32
MAPK1 P28482 1/20 0.32
HTT P42858 1/20 0.32
RAB9A P51151 1/20 0.32
TMPRSS15 P98073 6/20 0.31
PRSS1 P07477 5/20 0.31
THRB P10828 2/20 0.31
MAPT P10636 1/20 0.31
THRA P10827 1/20 0.31
MEN1 O00255 1/20 0.31
CYP3A4 P08684 1/20 0.31
KMT2A Q03164 1/20 0.31
RXRA P19793 1/20 0.31
RXRB P28702 1/20 0.31
RXRG P48443 1/20 0.31

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
SCHEMBL14588324 0.89 TSHR (0.38) TDP1L3MBTL1KDM4ETSHRNPSR1
SCHEMBL12154225 0.85 THRB (0.38) TDP1L3MBTL1RAB9APRSS1THRB
SCHEMBL12731125 0.84 THRB (0.36) TDP1L3MBTL1RAB9APRSS1THRB
SCHEMBL13668006 0.83 LMNA (0.41) LMNAMAPK1HTTRXRARXRB
SCHEMBL13664644 0.83 AKR1C3 (0.35)
SCHEMBL12731130 0.82 ALDH1A1 (0.35) TDP1L3MBTL1KDM4ETSHRNPSR1
SCHEMBL13664617 0.81 MAOB (0.37) KDM4ELMNAHTTMAPTMEN1
SCHEMBL14088532 0.81 LSS (0.37) THRBMAPTTHRAMEN1KMT2A
SCHEMBL12154240 0.80 ALDH1A1 (0.38) TDP1L3MBTL1KDM4ETSHRNPSR1
SCHEMBL13664622 0.78 LMNA (0.50) LMNAMAPK1HTTRAB9AMEN1

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
US-7597945-B2 Optical compensation film; mixture of three (meth)acrylate monomers: e.g. 2,7-bis(acryloyloxyhexyloxy-1,4-phenylenecarbonyloxy)fluorene, a bis 2-fluoroacrylate monomer, and a cyanobiphenyloxyalkanol ester of (meth)acrylic acid; hardness, heat resistance, weatherability, colorless, LC physical properties CHISSO CORPORATION (JP) 2009-10-06 US disclosed
US-7597945-B2 Optical compensation film; mixture of three (meth)acrylate monomers: e.g. 2,7-bis(acryloyloxyhexyloxy-1,4-phenylenecarbonyloxy)fluorene, a bis 2-fluoroacrylate monomer, and a cyanobiphenyloxyalkanol ester of (meth)acrylic acid; hardness, heat resistance, weatherability, colorless, LC physical properties CHISSO CORPORATION (JP) 2009-10-06 US disclosed