SCHEMBL27771900

SCHEMBL27771900

CCC(=O)OCCS(=O)(=O)c1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 7/20 0.53
PSIP1 O75475 1/20 0.50
LMNA P02545 1/20 0.47
MAPT P10636 1/20 0.45
KDM4E B2RXH2 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.43
HTT P42858 1/20 0.42
HDAC3 O15379 1/20 0.42
HDAC4 P56524 1/20 0.42
HDAC1 Q13547 1/20 0.42
HDAC7 Q8WUI4 1/20 0.42
HDAC2 Q92769 1/20 0.42
HDAC10 Q969S8 1/20 0.42
HDAC11 Q96DB2 1/20 0.42
HDAC8 Q9BY41 1/20 0.42
HDAC6 Q9UBN7 1/20 0.42
HDAC9 Q9UKV0 1/20 0.42
HDAC5 Q9UQL6 1/20 0.42

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
SCHEMBL25600275 0.84 LMNA (0.49) HSD11B1PSIP1LMNAMAPTKDM4E
SCHEMBL156165 0.84 HSD11B1 (0.55) HSD11B1PSIP1LMNAMAPTL3MBTL1
SCHEMBL27505035 0.84 KMT2A (0.48) HSD11B1LMNAKDM4EL3MBTL1
SCHEMBL9394874 0.84 MAPT (0.47) HSD11B1PSIP1LMNAMAPTKDM4E
SCHEMBL11407383 0.83 HSD11B1 (0.56) HSD11B1PSIP1LMNAMAPTL3MBTL1
SCHEMBL12237322 0.83 CA2 (0.53) HSD11B1PSIP1LMNAMAPTL3MBTL1
SCHEMBL111775 0.82 HSD11B1 (0.53) HSD11B1PSIP1LMNAMAPTL3MBTL1
SCHEMBL10894318 0.82 TSHR (0.45) HSD11B1LMNAKDM4E
SCHEMBL27488716 0.81 MMP1 (0.63) LMNAL3MBTL1SMN1; SMN2HTT
SCHEMBL7523793 0.81 HSD11B1 (0.51) HSD11B1PSIP1LMNAMAPTL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103509135-B Olefin polymerization catalyst component, preparation method and application thereof CHINA PETROLEUM & CHEMICAL 2015-07-22 CN disclosed
CN-103509135-A Olefin polymerization catalyst component, preparation method and application thereof CHINA PETROLEUM & CHEMICAL 2014-01-15 CN disclosed
CN-101987835-A Homopiperazine acethydrazide derivatives SHENZHEN INST OF XIANGYA BIOMEDICINE 2011-03-23 CN disclosed
CN-101503394-B High piperazine acetydrazide derivatives, and preparation and use thereof SHENZHEN XIANGYA BIOLOGY MEDICAMENT ACADEMY 2010-05-12 CN disclosed
CN-101503394-A High piperazine acetydrazide derivatives, and preparation and use thereof SHENZHEN XIANGYA BIOLOGY MEDIC (CN) 2009-08-12 CN disclosed