SCHEMBL546716

SCHEMBL546716

C=CC(O)C1CCC(COC(=O)CCCC(=O)OCC2CCC(C(O)C=C)CC2)CC1

nearest known ligand 0.44

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.44
ALDH1A1 P00352 2/20 0.39
GAA P10253 1/20 0.39
POLB P06746 1/20 0.39
TSHR P16473 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
SCHEMBL217791 0.78 LMNA (0.45) LMNAALDH1A1GAAPOLBTSHR
SCHEMBL27469061 0.76 LMNA (0.67) LMNAALDH1A1POLBTSHR
SCHEMBL2523203 0.74 LMNA (0.45) LMNAALDH1A1GAAPOLBTSHR
SCHEMBL2526794 0.74 LMNA (0.51) LMNAALDH1A1GAAPOLB
SCHEMBL3821626 0.73 LMNA (0.51) LMNAALDH1A1GAAPOLBTSHR
SCHEMBL4570313 0.71 LMNA (0.72) LMNAALDH1A1GAAPOLB
SCHEMBL1471843 0.70
SCHEMBL30581340 0.70 LMNA (0.50) LMNAPOLB
SCHEMBL130488 0.70
SCHEMBL8764246 0.70 UGT2B7 (0.32)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2097458-B2 NOVEL RADIATION CURABLE COMPOSITIONS AGFA GRAPHICS NV (BE) 2016-12-28 EP disclosed
EP-2121771-B2 NOVEL RADIATION CURABLE COMPOSITIONS AGFA GRAPHICS NV (BE) 2016-12-07 EP disclosed
US-8338499-B2 Amine co-initiators for radiation curable compositions AGFA GRAPHICS NV (BE) 2012-12-25 US disclosed
EP-2121771-B1 NOVEL RADIATION CURABLE COMPOSITIONS AGFA GRAPHICS NV (BE) 2012-06-27 EP disclosed
US-8110610-B2 Amine co-initiators for radiation curable compositions AGFA GRAPHICS N.V. (BE) 2012-02-07 US disclosed
US-8063115-B2 Radiation curable compositions AGFA GRAPHICS NV (BE) 2011-11-22 US disclosed
EP-1927632-B1 Novel radiation curable compositions AGFA GRAPHICS NV (BE) 2010-08-18 EP disclosed
US-20100048756-A1 NOVEL RADIATION CURABLE COMPOSITIONS AGFA GRAPHICS NV (BE) 2010-02-25 US disclosed
US-20100041784-A1 NOVEL RADIATION CURABLE COMPOSITIONS AGFA GRAPHICS NV (BE) 2010-02-18 US disclosed
US-20090326091-A1 NOVEL RADIATION CURABLE COMPOSITIONS AGFA GRAPHICS NV (BE) 2009-12-31 US disclosed
EP-1927632-A1 Novel radiation curable compositions Agfa Graphics N.V. (BE) 2008-06-04 EP disclosed