SCHEMBL1630735

SCHEMBL1630735

O=C(O)C(OCCO)=C(OCCO)OCCO

nearest known ligand 0.39

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.39
ACHE P22303 1/20 0.32
MAPK1 P28482 1/20 0.30

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
SCHEMBL1532808 0.87 TSHR (0.44) TSHRACHEMAPK1
SCHEMBL11054973 0.80 TSHR (0.39) TSHRACHEMAPK1
SCHEMBL3978913 0.73 MEN1 (0.52) TSHRMAPK1
SCHEMBL1630557 0.73 TSHR (0.38) TSHRACHE
SCHEMBL4303334 0.71 HCAR2 (0.34)
SCHEMBL468034 0.70
Hydrochloric Acid SCHEMBL29279104 0.70 CHRM1 (0.53) TSHRACHEMAPK1
SCHEMBL310738 0.69
SCHEMBL5079914 0.69 FNTA (0.35) TSHRACHE
SCHEMBL28924977 0.69 TSHR (0.42) TSHRACHEMAPK1

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-2017311-B1 ENERGY RAY-CURABLE INKJET PRINTING INK JSR CORP (JP) 2012-11-21 EP disclosed
US-7932300-B2 Energy beam curable type ink jet printing ink JSR CORPORATION (JP) 2011-04-26 US disclosed
US-20090118388-A1 ENERGY RAY-CURABLE INKJET PRINTING INK JSR CORPORATION (JP) 2009-05-07 US disclosed
EP-2017311-A1 ENERGY RAY-CURABLE INKJET PRINTING INK JSR Corporation (JP) 2009-01-21 EP disclosed