SCHEMBL28519984

SCHEMBL28519984

CCOC(=O)O.O=C(Cc1ccccc1)Cc1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.50
TDP1 Q9NUW8 1/20 0.50
ALDH1A1 P00352 3/20 0.48
MAPK1 P28482 1/20 0.48
CES2 O00748 1/20 0.48
CES1 P23141 1/20 0.48
AKR1B1 P15121 1/20 0.48
MMP8 P22894 2/20 0.47
PAM P19021 1/20 0.47
TSHR P16473 2/20 0.47
SMN1; SMN2 Q16637 2/20 0.46
KMT2A Q03164 3/20 0.46
MEN1 O00255 2/20 0.46
PPID Q08752 1/20 0.45
LMNA P02545 1/20 0.45
POLB P06746 1/20 0.45
HSD17B10 Q99714 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
Ether SCHEMBL9819680 0.84 CES1 (0.52) L3MBTL1TDP1ALDH1A1MAPK1CES2
SCHEMBL319873 0.81 PPID (0.54) L3MBTL1TDP1ALDH1A1MAPK1MMP8
Alcohol SCHEMBL10996109 0.81 CES1 (0.58) L3MBTL1TDP1ALDH1A1MAPK1CES2
Methyl Alcohol SCHEMBL11054071 0.81 CES1 (0.64) L3MBTL1TDP1ALDH1A1MAPK1CES2
SCHEMBL77563 0.81 CES1 (0.70) L3MBTL1TDP1ALDH1A1MAPK1CES2
SCHEMBL10646715 0.80 TDP1 (0.54) L3MBTL1TDP1ALDH1A1MAPK1PAM
SCHEMBL28280410 0.80 PPID (0.53) L3MBTL1TDP1ALDH1A1MAPK1MMP8
SCHEMBL6340092 0.80 KMT2A (0.49) L3MBTL1TDP1ALDH1A1MAPK1CES2
SCHEMBL1873977 0.80 ALDH1A1 (0.68) L3MBTL1ALDH1A1MAPK1CES2CES1
SCHEMBL112999 0.80 ALDH1A1 (0.68) L3MBTL1ALDH1A1MAPK1CES2CES1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109111537-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
CN-109111539-B Catalyst component for olefin polymerization and catalyst thereof 中国石油化工股份有限公司 2021-02-05 CN disclosed
CN-109111538-B Catalyst component for olefin polymerization and catalyst thereof 中国石油化工股份有限公司 2021-02-05 CN disclosed