SCHEMBL28547271

SCHEMBL28547271

CCOC(=O)COC(=O)c1ccccc1-c1ccccc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SCN1A P35498 3/20 0.58
SCN2A Q99250 3/20 0.58
SCN3A Q9NY46 3/20 0.58
TSHR P16473 2/20 0.54
LMNA P02545 1/20 0.53
SQOR Q9Y6N5 1/20 0.49
HSD17B10 Q99714 3/20 0.47
ALDH1A1 P00352 1/20 0.47
CHRNB2 P17787 3/20 0.47
CHRNB4 P30926 3/20 0.47
CHRNA3 P32297 3/20 0.47
CHRNA4 P43681 3/20 0.47
ERN1 O75460 1/20 0.46
MAPK10 P53779 1/20 0.46
KDM4E B2RXH2 2/20 0.46
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
SMN1; SMN2 Q16637 2/20 0.45
NPC1 O15118 1/20 0.45
MAPT P10636 1/20 0.45

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
SCHEMBL396552 0.89 TSHR (0.69) SCN1ASCN2ASCN3ATSHRLMNA
SCHEMBL28278000 0.88 SCN1A (0.59) SCN1ASCN2ASCN3ATSHRLMNA
Bicarbonate SCHEMBL27449726 0.87 TSHR (0.67) SCN1ASCN2ASCN3ATSHRLMNA
SCHEMBL28278039 0.86 SCN1A (0.61) SCN1ASCN2ASCN3ATSHRLMNA
SCHEMBL27686802 0.86 TSHR (0.65) SCN1ASCN2ASCN3ATSHRLMNA
SCHEMBL29014243 0.85 TSHR (0.74) TSHRLMNAHSD17B10ALDH1A1MAPK10
SCHEMBL28279360 0.85 TSHR (0.60) SCN1ASCN2ASCN3ATSHRLMNA
SCHEMBL1665510 0.84 TSHR (0.61) SCN1ASCN2ASCN3ATSHRLMNA
SCHEMBL1639856 0.84 TSHR (0.78) TSHRLMNAHSD17B10ALDH1A1MAPK10
SCHEMBL27686775 0.82 TSHR (0.59) SCN1ASCN2ASCN3ATSHRLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109553705-B Catalyst component for olefin polymerization and preparation method thereof 中国石油化工股份有限公司 2021-04-13 CN claimed
CN-109553712-B Catalyst component for olefin polymerization and catalyst thereof 中国石油化工股份有限公司 2021-03-16 CN claimed
CN-109553705-B Catalyst component for olefin polymerization and preparation method thereof 中国石油化工股份有限公司 2021-04-13 CN disclosed
CN-109553712-B Catalyst component for olefin polymerization and catalyst thereof 中国石油化工股份有限公司 2021-03-16 CN disclosed