SCHEMBL245029

SCHEMBL245029

C=C(C)C(=O)OC(OC(=O)CCCCCCCCCCC)C(C)O

nearest known ligand 0.54

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.54
MAPT P10636 2/20 0.47
MAPK1 P28482 1/20 0.47
ALDH1A1 P00352 1/20 0.45
TSHR P16473 2/20 0.45
PRKCA P17252 1/20 0.42
PRKCE Q02156 1/20 0.42
PRKCQ Q04759 1/20 0.42
PRKCD Q05655 1/20 0.42
DGKA P23743 1/20 0.41
KDM4E B2RXH2 1/20 0.41
DUSP3 P51452 1/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
LPAR1 Q92633 2/20 0.41
LPAR3 Q9UBY5 2/20 0.41
ENPP2 Q13822 1/20 0.41

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
SCHEMBL245004 1.00 LMNA (0.54) LMNAMAPTMAPK1ALDH1A1TSHR
SCHEMBL245323 1.00 LMNA (0.54) LMNAMAPTMAPK1ALDH1A1TSHR
SCHEMBL4975150 0.94 LMNA (0.43) LMNAMAPTMAPK1ALDH1A1TSHR
SCHEMBL4980922 0.92 LMNA (0.41) LMNAMAPTMAPK1ALDH1A1TSHR
SCHEMBL244516 0.92 PRKCA (0.50) LMNAPRKCAPRKCEPRKCQPRKCD
SCHEMBL27466370 0.87 TSHR (0.37) LMNAMAPTMAPK1ALDH1A1TSHR
SCHEMBL4975784 0.86 TSHR (0.41) LMNAALDH1A1TSHR
SCHEMBL11743243 0.83 LMNA (0.59) LMNAMAPTMAPK1ALDH1A1TSHR
SCHEMBL242459 0.81 ALDH1A1 (0.52) LMNAMAPTALDH1A1TSHRKDM4E
SCHEMBL27481368 0.80 TSHR (0.37) LMNAALDH1A1TSHR

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-9221738-B2 Method and system for purifying monomers EVONIK RÖHM GMBH (DE) 2015-12-29 US disclosed
US-20120000764-A1 METHOD AND SYSTEM FOR PURIFYING MONOMERS EVONIK DEGUSSA GMBH (DE) 2012-01-05 US disclosed