SCHEMBL5085889

SCHEMBL5085889

CC(CC(=O)OCc1ccccc1)OC(=O)c1ccccc1.CC(CC(=O)OCc1ccccc1)OC(=O)c1ccccc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.58
TDP1 Q9NUW8 2/20 0.58
SLC6A2 P23975 1/20 0.58
SLC6A3 Q01959 1/20 0.58
ALDH1A1 P00352 3/20 0.50
LMNA P02545 3/20 0.50
SLC15A1 P46059 2/20 0.50
MAPK1 P28482 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
MAPT P10636 1/20 0.48
HPGD P15428 1/20 0.48
POLB P06746 2/20 0.46
CYP1A2 P05177 1/20 0.46
CYP2D6 P10635 1/20 0.46
SCN1A P35498 1/20 0.46
SCN2A Q99250 1/20 0.46
SCN3A Q9NY46 1/20 0.46
NPC1 O15118 2/20 0.45
MMP9 P14780 1/20 0.44
RAB9A P51151 2/20 0.44

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
SCHEMBL5080019 1.00 KMT2A (0.58) KMT2ATDP1SLC6A2SLC6A3ALDH1A1
SCHEMBL28551065 0.86 KMT2A (0.55) KMT2ATDP1SLC6A2SLC6A3ALDH1A1
SCHEMBL888349 0.85 NPC1 (0.50) KMT2AALDH1A1LMNAPOLBCYP1A2
SCHEMBL888507 0.84 ALDH1A1 (0.50) TDP1ALDH1A1LMNAPOLBCYP1A2
SCHEMBL28277985 0.83 TDP1 (0.55) KMT2ATDP1SLC6A2SLC6A3ALDH1A1
SCHEMBL26384421 0.82 ALDH1A1 (0.50) KMT2ATDP1SLC6A2SLC6A3ALDH1A1
SCHEMBL26383016 0.82 ALDH1A1 (0.54) KMT2ATDP1SLC6A2SLC6A3ALDH1A1
SCHEMBL5082911 0.81 LMNA (0.54) KMT2AALDH1A1LMNAMAPTPOLB
SCHEMBL29302944 0.81 LMNA (0.54) KMT2AALDH1A1LMNAMAPTPOLB
SCHEMBL5082895 0.81 PDCD1 (0.56) KMT2AALDH1A1LMNAMAPTPOLB

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-7351778-B2 Catalyst component for olefin polymerization and catalyst comprising the same CHINA PETROLEUM & CHEMICAL CORPORATION (CN) 2008-04-01 US disclosed
US-20060287446-A1 Catalyst component for olefin polymerization and catalyst comprising the same BEIJING RESEARCH INSTITUTE OF CHEMICAL INDUSTRY CHINA PETROLEUM & CHEMICAL COPORATION (CN) 2006-12-21 US disclosed