SCHEMBL27511646

SCHEMBL27511646

CCC(=O)OCC1CCCC1c1ccc(-n2nnnc2C)c(Cl)c1

nearest known ligand 0.35

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ SLC6A4 P31645 7/20 0.35
▸ SLC6A3 Q01959 7/20 0.35
▸ L3MBTL1 Q9Y468 1/20 0.35
▸ HDAC8 Q9BY41 2/20 0.34
▸ HDAC6 Q9UBN7 2/20 0.34
▸ HDAC1 Q13547 1/20 0.34
▸ SCN9A Q15858 1/20 0.34
▸ SMURF1 Q9HCE7 1/20 0.33
▸ SLC5A1 P13866 1/20 0.33
▸ SLC5A2 P31639 1/20 0.33

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
SCHEMBL27557284 0.98 SLC6A4 (0.35) SLC6A4SLC6A3L3MBTL1SCN9ASMURF1
SCHEMBL27492344 0.85 SCN9A (0.35) SLC6A4SLC6A3SCN9A
SCHEMBL27466734 0.75 HDAC8 (0.38) SLC6A4SLC6A3HDAC8HDAC6HDAC1
SCHEMBL27466722 0.74 HDAC8 (0.48) HDAC8HDAC6HDAC1
SCHEMBL27466733 0.74 HDAC8 (0.38) SLC6A4SLC6A3HDAC8HDAC6HDAC1
SCHEMBL27482758 0.73 MDM2 (0.41) SLC6A3HDAC8HDAC6HDAC1
SCHEMBL27466725 0.72 KMT2A (0.45) L3MBTL1HDAC8HDAC6HDAC1
SCHEMBL27480883 0.70 HDAC8 (0.51) SLC6A4SLC6A3HDAC8HDAC6HDAC1
SCHEMBL2666999 0.68 SLC5A1 (0.40) L3MBTL1SLC5A1SLC5A2
SCHEMBL27504948 0.67 HDAC8 (0.38) SLC6A4SLC6A3L3MBTL1HDAC8HDAC6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1209362-C Tetrazolyl-phenyl acetamide glucokinase activators HOFFMANN LA ROCHE (CH) 2005-07-06 — — CN disclosed
CN-1466584-A Tetrazolyl-phenyl acetamide glucokinase activators - 2004-01-07 — — CN disclosed
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