SCHEMBL28902007

SCHEMBL28902007

CC(C(=O)NN(C(C)(C)C)C(C)(C)C)c1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRM7 Q14831 2/20 0.46
POLB P06746 1/20 0.46
LMNA P02545 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
HDAC3 O15379 1/20 0.43
HDAC4 P56524 1/20 0.43
HDAC1 Q13547 1/20 0.43
HDAC7 Q8WUI4 1/20 0.43
HDAC2 Q92769 1/20 0.43
HDAC10 Q969S8 1/20 0.43
HDAC11 Q96DB2 1/20 0.43
HDAC8 Q9BY41 1/20 0.43
HDAC6 Q9UBN7 1/20 0.43
HDAC9 Q9UKV0 1/20 0.43
HDAC5 Q9UQL6 1/20 0.43
ERCC1 P07992 1/20 0.42
ERCC4 Q92889 1/20 0.42
ELOVL1 Q9BW60 2/20 0.41
KCNQ2 O43526 1/20 0.41
PTGS2 P35354 1/20 0.41

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
SCHEMBL6904220 0.80 GRM7 (0.50) GRM7POLBLMNAL3MBTL1HDAC3
SCHEMBL7559906 0.77 HDAC3 (0.63) GRM7POLBLMNAL3MBTL1HDAC3
SCHEMBL4729281 0.77 HDAC3 (0.63) GRM7POLBLMNAL3MBTL1HDAC3
SCHEMBL14680987 0.77 GPR88 (0.51) GRM7POLBLMNAL3MBTL1ERCC1
SCHEMBL27850345 0.76 L3MBTL1 (0.51) GRM7POLBLMNAL3MBTL1HDAC3
SCHEMBL9486611 0.75 ALOX5 (0.49) GRM7POLBLMNAL3MBTL1HDAC3
SCHEMBL2055558 0.74 LMNA (0.55) GRM7POLBLMNAL3MBTL1HDAC3
SCHEMBL3135701 0.74 LMNA (0.55) GRM7POLBLMNAL3MBTL1HDAC3
SCHEMBL2055561 0.74 LMNA (0.55) GRM7POLBLMNAL3MBTL1HDAC3
SCHEMBL9848999 0.72 GRM7 (0.53) GRM7POLBLMNAL3MBTL1HDAC3

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-111492012-A Impact-resistant copolymers based on single-site catalysts with excellent mechanical and optical properties 博里利斯股份公司 2020-08-04 CN disclosed