SCHEMBL13764332

SCHEMBL13764332

CN(C1CC1)S(=O)(=O)NC(=O)C(C)(C)C

nearest known ligand 0.37

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.31
ALDH1A1 P00352 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30
LMNA P02545 1/20 0.30
HTT P42858 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
NPSR1 Q6W5P4 1/20 0.30

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
SCHEMBL2759554 0.79 L3MBTL1 (0.38) GAAALDH1A1L3MBTL1LMNAHTT
SCHEMBL85558 0.76 CA1 (0.44) ALDH1A1L3MBTL1HTT
SCHEMBL13768117 0.76 USP2 (0.33) GAAL3MBTL1LMNAHTTSMN1; SMN2
SCHEMBL85557 0.74 NPSR1 (0.35) ALDH1A1L3MBTL1LMNAHTTSMN1; SMN2
SCHEMBL13799203 0.71 GAA (0.33) GAAALDH1A1L3MBTL1
SCHEMBL3220299 0.70 KMT2A (0.45) GAAALDH1A1L3MBTL1LMNAHTT
SCHEMBL85044 0.69 CA1 (0.35) ALDH1A1LMNAHTT
SCHEMBL92825 0.69 CHRNB4 (0.35) GAAALDH1A1
SCHEMBL12880363 0.68 SCN9A (0.37) GAAALDH1A1L3MBTL1
SCHEMBL85214 0.67 CA1 (0.43) ALDH1A1LMNAHTT

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
US-7563785-B2 Quetiapine analogs and methods of use thereof HYPNION, INC. (US) 2009-07-21 US disclosed
US-7482460-B2 Doxepin analogs and methods of use thereof HYPNION, INC. (US) 2009-01-27 US disclosed