SCHEMBL27779362

SCHEMBL27779362

COc1ccc2cc(OCc3ccccc3)c(C(OC=O)c3ccccc3)cc2c1

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HDAC8 Q9BY41 1/20 0.44
MAOB P27338 1/20 0.41
FLT3 P36888 1/20 0.40
ALOX5 P09917 1/20 0.40
ABCB1 P08183 3/20 0.40
HTR1A P08908 1/20 0.40
DRD2 P14416 1/20 0.40
PDGFRB P09619 1/20 0.40
PDGFRA P16234 1/20 0.40
CTSL P07711 1/20 0.39
CTSB P07858 1/20 0.39
APP P05067 1/20 0.39
MTNR1A P48039 2/20 0.39
MTNR1B P49286 1/20 0.39
SRD5A1 P18405 1/20 0.38
SRD5A2 P31213 1/20 0.38

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
SCHEMBL28044733 0.77 ENPP2 (0.39) HTR1AAPPSRD5A1SRD5A2
SCHEMBL7827220 0.76 PDGFRB (0.59) HDAC8MAOBALOX5ABCB1HTR1A
SCHEMBL2990559 0.73 KDM4E (0.57) HDAC8MAOBFLT3CTSLAPP
SCHEMBL29375765 0.73 KDM4E (0.57) HDAC8MAOBFLT3CTSLAPP
SCHEMBL2992089 0.72 MAOB (0.53) HDAC8MAOBFLT3ALOX5ABCB1
SCHEMBL30461777 0.72 MAOB (0.53) HDAC8MAOBFLT3ALOX5ABCB1
SCHEMBL21436935 0.72 HDAC8 (0.51) HDAC8MAOBABCB1HTR1ADRD2
SCHEMBL27960499 0.71 ALOX5 (0.48) MAOBALOX5MTNR1ASRD5A2
SCHEMBL8204838 0.71 HDAC8 (0.53) HDAC8MAOBFLT3CTSLAPP
SCHEMBL19612478 0.70 ALOX5 (0.65) MAOBFLT3ALOX5PDGFRBPDGFRA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105520943-A Anti-diabetics oral pharmaceutical composition ZHU ZHONGLIANG 2016-04-27 CN disclosed
CN-105434434-A Antidiabetic oral drug composition ZHU ZHONGLIANG 2016-03-30 CN disclosed
CN-105434433-A Antidiabetic oral drug composition ZHU ZHONGLIANG 2016-03-30 CN disclosed
CN-105412095-A Anti-diabetes oral drug composition ZHU ZHONGLIANG 2016-03-23 CN disclosed
CN-105287535-A Anti-diabetes oral pharmaceutical composition ZHU ZHONGLIANG 2016-02-03 CN disclosed
CN-105232546-A Anti-diabetic oral drug composition ZHU ZHONGLIANG 2016-01-13 CN disclosed
CN-105232552-A Anti-diabetic oral drug composition ZHU ZHONGLIANG 2016-01-13 CN disclosed
CN-105213384-A A kind of diabetes combination of oral medication ZHU ZHONGLIANG 2016-01-06 CN disclosed
CN-105213379-A A kind of diabetes combination of oral medication ZHU ZHONGLIANG 2016-01-06 CN disclosed
CN-105213382-A A kind of diabetes combination of oral medication ZHU ZHONGLIANG 2016-01-06 CN disclosed
CN-105213385-A A kind of diabetes combination of oral medication ZHU ZHONGLIANG 2016-01-06 CN disclosed
CN-105213387-A A kind of diabetes combination of oral medication ZHU ZHONGLIANG 2016-01-06 CN disclosed
CN-105213381-A A kind of diabetes combination of oral medication ZHU ZHONGLIANG 2016-01-06 CN disclosed
CN-105213383-A A kind of diabetes combination of oral medication ZHU ZHONGLIANG 2016-01-06 CN disclosed
CN-105193797-A Diabetes mellitus resistant oral medicine composition ZHU ZHONGLIANG 2015-12-30 CN disclosed
CN-105193796-A Diabetes mellitus resistant oral medicine composition ZHU ZHONGLIANG 2015-12-30 CN disclosed
CN-101687828-A Thiadiazole derivatives as antidiabetic agents NOVARTIS AG 2010-03-31 CN disclosed