SCHEMBL3268510

SCHEMBL3268510

C=C(C)C(=O)OC.C=C(C)C(=O)OCCOc1ccccc1.C=C(CC=C(C)C(=O)O)C(=O)OCc1ccccc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.39
APEX1 P27695 1/20 0.39
HTT P42858 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
THRB P10828 1/20 0.39
MAPT P10636 2/20 0.37
L3MBTL1 Q9Y468 2/20 0.37
NPC1 O15118 5/20 0.36
MEN1 O00255 3/20 0.36
KMT2A Q03164 3/20 0.36
KDM4E B2RXH2 3/20 0.36
LMNA P02545 3/20 0.36
RAB9A P51151 5/20 0.36
ALDH1A1 P00352 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
TSHR P16473 1/20 0.36
TP53 P04637 1/20 0.35
MTNR1A P48039 1/20 0.34
MTNR1B P49286 1/20 0.34
MAOB P27338 1/20 0.34

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
SCHEMBL3267903 0.93 THRB (0.51) POLBAPEX1HTTTDP1THRB
SCHEMBL1224847 0.91 TDP1 (0.44) POLBAPEX1HTTTDP1THRB
SCHEMBL1228085 0.90 ALDH1A1 (0.43) HTTTDP1L3MBTL1NPC1MEN1
SCHEMBL2946643 0.89 ALDH1A1 (0.37) POLBAPEX1HTTTDP1L3MBTL1
SCHEMBL2097594 0.88 ALDH1A1 (0.43) HTTTDP1L3MBTL1NPC1MEN1
SCHEMBL6319583 0.87 TSHR (0.44) POLBAPEX1HTTTDP1L3MBTL1
SCHEMBL3267858 0.86 THRB (0.47) POLBAPEX1HTTTDP1THRB
SCHEMBL1971105 0.86 TDP1 (0.44) POLBAPEX1HTTTDP1THRB
SCHEMBL18662526 0.85 ALDH1A1 (0.45) HTTTDP1L3MBTL1NPC1MEN1
SCHEMBL15510927 0.85 TSHR (0.44) POLBAPEX1HTTTDP1THRB

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-8664296-B2 Ink set for ink jet recording and ink jet recording method FUJIFILM CORPORATION (JP) 2014-03-04 US claimed
EP-2196506-A1 Ink set for inkjet recording FUJIFILM Corporation (JP) 2010-06-16 EP disclosed
US-20100144943-A1 INK SET FOR INKJET RECORDING FUJIFILM CORPORATION (JP) 2010-06-10 US disclosed