SCHEMBL13664625

SCHEMBL13664625

C=C(C)C(=O)OCOc1ccc(OCOc2ccc(OC(=O)c3ccc(OCOC(=O)C(=C)C)cc3)cc2C)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.43
TDP1 Q9NUW8 2/20 0.43
APEX1 P27695 1/20 0.43
HTT P42858 1/20 0.43
KMT2A Q03164 8/20 0.39
MAPT P10636 6/20 0.39
KDM4E B2RXH2 2/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
MAPK1 P28482 1/20 0.38
LMNA P02545 2/20 0.37
PPARD Q03181 2/20 0.37
GBA1 P04062 1/20 0.36
ELANE P08246 1/20 0.36
GAA P10253 3/20 0.35
HPGD P15428 1/20 0.35
ALDH1A1 P00352 1/20 0.35
GLA P06280 1/20 0.35
NPBWR1 P48145 1/20 0.35
PPARG P37231 1/20 0.35
PPARA Q07869 1/20 0.35

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
SCHEMBL11986094 0.94 POLB (0.43) POLBTDP1APEX1HTTKMT2A
SCHEMBL19757163 0.91 POLB (0.41) POLBTDP1APEX1HTTKMT2A
SCHEMBL14026812 0.90 KMT2A (0.44) POLBTDP1APEX1HTTKMT2A
SCHEMBL13664631 0.90 KMT2A (0.39) POLBTDP1KMT2AMAPTKDM4E
SCHEMBL13289581 0.89 KMT2A (0.46) POLBTDP1APEX1HTTKMT2A
SCHEMBL23137082 0.88 TDP1 (0.52) POLBTDP1APEX1HTTKMT2A
SCHEMBL17488397 0.88 TDP1 (0.52) POLBTDP1APEX1HTTKMT2A
SCHEMBL12733723 0.87 POLB (0.38) POLBTDP1APEX1HTTKMT2A
SCHEMBL12733748 0.87 POLB (0.38) POLBTDP1APEX1HTTKMT2A
SCHEMBL16016918 0.87 POLB (0.43) POLBTDP1APEX1HTTKMT2A

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 1 patent. 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