SCHEMBL13616627

SCHEMBL13616627

C=C(C)C(=O)OCC(=O)OC1C2OC(=O)C3C2OC1C3C(=O)OCC1CCCO1

nearest known ligand 0.36

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.36
POLB P06746 1/20 0.35
ALDH1A1 P00352 3/20 0.34
HTT P42858 1/20 0.33
KMT2A Q03164 1/20 0.32
GAA P10253 1/20 0.31
MAPK1 P28482 1/20 0.31
TP53 P04637 1/20 0.31
PKM P14618 1/20 0.31
RAB9A P51151 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31

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
SCHEMBL13616633 0.90 LMNA (0.35) LMNAPOLBALDH1A1HTTKMT2A
SCHEMBL13616624 0.87 ALDH1A1 (0.40) ALDH1A1
SCHEMBL13616619 0.87 LMNA (0.37) LMNAPOLBALDH1A1HTTKMT2A
SCHEMBL15745712 0.85 LMNA (0.40) LMNAPOLBALDH1A1HTTKMT2A
SCHEMBL13616638 0.83
SCHEMBL13616621 0.83 FABP7 (0.31)
SCHEMBL12416009 0.82
SCHEMBL13616640 0.81 KDM4E (0.31)
SCHEMBL13616623 0.81
SCHEMBL11964231 0.80 ALDH1A1 (0.30) ALDH1A1

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-20090286937-A1 CHEMICALLY AMPLIFIED POSITIVE RESIST COMPOSITION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-11-19 US disclosed
US-20090286937-A1 CHEMICALLY AMPLIFIED POSITIVE RESIST COMPOSITION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-11-19 US disclosed