SCHEMBL28834545

SCHEMBL28834545

CCC(=O)c1ccccc1OOC(C)(OC)OC

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ABCB1 P08183 7/20 0.42
NPC1 O15118 1/20 0.41
KDM4E B2RXH2 2/20 0.40
KMT2A Q03164 2/20 0.40
MEN1 O00255 1/20 0.40
USP2 O75604 1/20 0.40
TSHR P16473 1/20 0.40
HSD17B10 Q99714 1/20 0.40
IDO1 P14902 1/20 0.40
TDO2 P48775 1/20 0.40
ALDH1A1 P00352 3/20 0.38
TDP1 Q9NUW8 1/20 0.38
POLB P06746 1/20 0.38
RAB9A P51151 1/20 0.38
HTT P42858 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
ELANE P08246 1/20 0.37
CTSD P07339 1/20 0.37
HMGCR P04035 1/20 0.37

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
SCHEMBL28100256 0.84 KMT2A (0.44) ABCB1NPC1KDM4EKMT2AMEN1
SCHEMBL28834519 0.84 HDAC8 (0.49) KDM4EKMT2AMEN1TSHRALDH1A1
SCHEMBL28952535 0.84 HDAC8 (0.49) KDM4EKMT2AMEN1TSHRALDH1A1
SCHEMBL28100252 0.83 LMNA (0.46) ABCB1KDM4EKMT2ATSHRHSD17B10
SCHEMBL878658 0.77 NPC1 (0.64) NPC1KMT2AIDO1TDO2ALDH1A1
SCHEMBL29738645 0.77 NPC1 (0.64) NPC1KMT2AIDO1TDO2ALDH1A1
SCHEMBL13020272 0.76 TSHR (0.47) ABCB1NPC1KDM4EKMT2AMEN1
SCHEMBL28100249 0.76 L3MBTL1 (0.43) KDM4ETSHRHSD17B10IDO1HTT
SCHEMBL28812389 0.75 ABCB1 (0.55) ABCB1NPC1KDM4EKMT2AMEN1
SCHEMBL28100114 0.74 KMT2A (0.43) ABCB1NPC1KDM4EKMT2AMEN1

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
CN-106010384-A OPTICAL FILM WITH ADHESIVE LAYER AND LIQUID CRYSTAL DISPLAY DEVICE 住友化学株式会社 2016-10-12 CN disclosed
CN-106010382-A Optical laminate and liquid crystal display device 住友化学株式会社 2016-10-12 CN disclosed