SCHEMBL28089954

SCHEMBL28089954

CCOCCC(=O)O.COCCC(=O)O.COCCC(=O)OC

nearest known ligand 0.48

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.48
ALDH1A1 P00352 4/20 0.42
KMT2A Q03164 2/20 0.34
MEN1 O00255 1/20 0.34
LMNA P02545 2/20 0.33
CA12 O43570 2/20 0.33
CA14 Q9ULX7 2/20 0.33
FFAR3 O14843 1/20 0.33
HDAC3 O15379 1/20 0.33
HDAC1 Q13547 1/20 0.33
HDAC2 Q92769 1/20 0.33
HDAC8 Q9BY41 1/20 0.33
KDM4E B2RXH2 1/20 0.33
POLB P06746 1/20 0.33
HPGD P15428 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
MAPT P10636 1/20 0.32
HTT P42858 1/20 0.32
HSD17B10 Q99714 1/20 0.32

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
SCHEMBL1357249 0.88 TSHR (0.50) TSHRALDH1A1KMT2AMEN1LMNA
SCHEMBL29074729 0.87 ALDH1A1 (0.41) TSHRALDH1A1LMNAPOLBSMN1; SMN2
SCHEMBL28399926 0.86 ALDH1A1 (0.50) TSHRALDH1A1KMT2AMEN1LMNA
SCHEMBL108174 0.86
Acetic Acid SCHEMBL1626812 0.84 TSHR (0.50) TSHRALDH1A1KMT2AMEN1LMNA
SCHEMBL25444889 0.84 TSHR (0.60) TSHRALDH1A1KMT2AMEN1LMNA
Ether SCHEMBL27717982 0.82 TSHR (0.48) TSHRALDH1A1KMT2AMEN1LMNA
SCHEMBL15164975 0.82 TSHR (0.58) TSHRALDH1A1KMT2AMEN1LMNA
SCHEMBL15763881 0.82 TSHR (0.52) TSHRALDH1A1KMT2AMEN1LMNA
SCHEMBL31665495 0.82 TSHR (0.58) TSHRALDH1A1KMT2AMEN1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103597381-B Color filter, CCD sensor, CMOS sensor, organic CMOS sensor, and solid-state image sensor 富士胶片株式会社 2016-07-20 CN disclosed