SCHEMBL10410656

SCHEMBL10410656

CC(=O)Nc1ccc(C(=O)C(C)N2CCSCC2)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 1/20 0.52
SLC6A3 Q01959 1/20 0.52
ALDH1A1 P00352 5/20 0.45
MEN1 O00255 5/20 0.45
KMT2A Q03164 5/20 0.45
CYP2C19 P33261 3/20 0.45
CYP1A2 P05177 2/20 0.45
CYP2D6 P10635 1/20 0.45
CYP2C9 P11712 1/20 0.45
PKM P14618 2/20 0.44
KDM4E B2RXH2 2/20 0.44
MAPT P10636 2/20 0.44
GAA P10253 1/20 0.44
GRIN1 Q05586 1/20 0.44
GRIN2B Q13224 1/20 0.44
SMN1; SMN2 Q16637 2/20 0.43
CYP3A4 P08684 1/20 0.43
GFER P55789 1/20 0.43
L3MBTL1 Q9Y468 2/20 0.43
NPC1 O15118 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
SCHEMBL10411257 0.85 SLC6A2 (0.49) SLC6A2SLC6A3ALDH1A1MEN1KMT2A
SCHEMBL10391072 0.85 SLC6A2 (0.65) SLC6A2SLC6A3ALDH1A1MEN1KMT2A
SCHEMBL9796840 0.85 SLC6A2 (0.65) SLC6A2SLC6A3ALDH1A1MEN1KMT2A
Hydrochloric Acid SCHEMBL9796932 0.84 SLC6A2 (0.64) SLC6A2SLC6A3ALDH1A1MEN1KMT2A
SCHEMBL10390983 0.84 SLC6A2 (0.53) SLC6A2SLC6A3ALDH1A1MEN1KMT2A
Hydrochloric Acid SCHEMBL10391005 0.84 SLC6A2 (0.64) SLC6A2SLC6A3ALDH1A1MEN1KMT2A
SCHEMBL10409601 0.83 L3MBTL1 (0.53) SLC6A2SLC6A3ALDH1A1MEN1KMT2A
Hydrochloric Acid SCHEMBL10391080 0.83 SLC6A2 (0.52) SLC6A2SLC6A3ALDH1A1MEN1KMT2A
Hydrochloric Acid SCHEMBL9596287 0.82 L3MBTL1 (0.52) SLC6A2SLC6A3ALDH1A1MEN1KMT2A
SCHEMBL10701944 0.81 MEN1 (0.48) SLC6A2SLC6A3ALDH1A1MEN1KMT2A

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
US-4933442-A 1-(acetylaminophenyl)-2-aminopropanone derivatives and central nervous system antidepressant compositions LABORATOIRE L. LAFON (FR) 1990-06-12 US claimed