SCHEMBL21335680

SCHEMBL21335680

CC(C)CCOC(=O)c1cc(C(=O)OCCC(C)C)c(C(=O)OCCC(C)C)cc1C(=O)OCCC(=O)OCc1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.48
TDP1 Q9NUW8 4/20 0.48
L3MBTL1 Q9Y468 3/20 0.48
TSHR P16473 3/20 0.48
MAPK1 P28482 2/20 0.48
CYP3A4 P08684 1/20 0.48
LMNA P02545 1/20 0.41
CASP3 P42574 1/20 0.41
RAB9A P51151 1/20 0.41
SENP8 Q96LD8 1/20 0.41
SENP7 Q9BQF6 1/20 0.41
SENP6 Q9GZR1 1/20 0.41
GABRA1 P14867 1/20 0.41
GABRB1 P18505 1/20 0.41
GABRA3 P34903 1/20 0.41
GABRB2 P47870 1/20 0.41
SLC6A2 P23975 1/20 0.41
SLC6A3 Q01959 1/20 0.41
KMT2A Q03164 1/20 0.41
CTSK P43235 2/20 0.40

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
SCHEMBL16344760 0.85 ALDH1A1 (0.53) ALDH1A1TDP1L3MBTL1MAPK1LMNA
SCHEMBL16344671 0.84 ALDH1A1 (0.67) ALDH1A1TDP1L3MBTL1TSHRMAPK1
SCHEMBL11048345 0.82 ALDH1A1 (0.50) ALDH1A1TDP1L3MBTL1TSHRMAPK1
SCHEMBL4890742 0.80 ALDH1A1 (0.58) ALDH1A1TDP1L3MBTL1TSHRMAPK1
SCHEMBL20695629 0.78 ALDH1A1 (0.56) ALDH1A1TDP1L3MBTL1TSHRMAPK1
SCHEMBL4955877 0.78 ALDH1A1 (0.54) ALDH1A1TDP1L3MBTL1TSHRMAPK1
SCHEMBL28377873 0.76 ALDH1A1 (0.53) ALDH1A1TDP1L3MBTL1MAPK1LMNA
SCHEMBL28561356 0.76 ALDH1A1 (0.50) ALDH1A1TDP1L3MBTL1TSHRMAPK1
SCHEMBL23734556 0.76 TDP1 (0.71) ALDH1A1TDP1L3MBTL1TSHRMAPK1
SCHEMBL28407232 0.76 ALDH1A1 (0.50) ALDH1A1TDP1TSHRMAPK1LMNA

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
US-10409158-B2 Coloring composition, cured film, color filter, method for producing color filter, solid-state imaging element, and image display device FUJIFILM CORPORATION (JP) 2019-09-10 US disclosed