SCHEMBL27948844

SCHEMBL27948844

CCCS(=O)(=O)CCCC(=O)c1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.56
TDP1 Q9NUW8 2/20 0.56
LMNA P02545 1/20 0.56
MAPT P10636 1/20 0.56
HDAC1 Q13547 5/20 0.51
HDAC8 Q9BY41 5/20 0.51
HDAC3 O15379 1/20 0.51
HDAC4 P56524 1/20 0.51
HDAC7 Q8WUI4 1/20 0.51
HDAC2 Q92769 1/20 0.51
HDAC10 Q969S8 1/20 0.51
HDAC11 Q96DB2 1/20 0.51
HDAC6 Q9UBN7 1/20 0.51
HDAC9 Q9UKV0 1/20 0.51
HDAC5 Q9UQL6 1/20 0.51
HSD11B1 P28845 1/20 0.51
NPC1 O15118 1/20 0.50
CASP3 P42574 1/20 0.50
RAB9A P51151 1/20 0.50
SENP8 Q96LD8 1/20 0.50

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
SCHEMBL15339729 0.81 TDP1 (0.62) L3MBTL1TDP1LMNAMAPTHDAC1
Valerophenone SCHEMBL5615151 0.80 L3MBTL1 (0.72) L3MBTL1TDP1LMNAMAPTHDAC1
Valerophenone SCHEMBL50014 0.80 L3MBTL1 (0.72) L3MBTL1TDP1LMNAMAPTHDAC1
Valerophenone SCHEMBL9725402 0.80 L3MBTL1 (0.72) L3MBTL1TDP1LMNAMAPTHDAC1
Valerophenone SCHEMBL27921461 0.78 L3MBTL1 (0.69) L3MBTL1TDP1LMNAMAPTHDAC1
SCHEMBL50000 0.78 L3MBTL1 (0.76) L3MBTL1TDP1LMNAMAPTHDAC1
SCHEMBL9725525 0.78 L3MBTL1 (0.76) L3MBTL1TDP1LMNAMAPTHDAC1
Valerophenone SCHEMBL9858470 0.78 L3MBTL1 (0.69) L3MBTL1TDP1LMNAMAPTHDAC1
SCHEMBL28538201 0.78 RECQL (0.49) L3MBTL1TDP1LMNAMAPTHSD11B1
SCHEMBL7583452 0.77 TDP1 (0.62) L3MBTL1TDP1LMNAMAPTHDAC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103509135-A Olefin polymerization catalyst component, preparation method and application thereof CHINA PETROLEUM & CHEMICAL 2014-01-15 CN disclosed