SCHEMBL9768709

SCHEMBL9768709

CN(C)CC(=O)N1c2ccc(Cl)cc2N(C)S(=O)(=O)c2ccccc21

nearest known ligand 0.56

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.43
KDM4E B2RXH2 2/20 0.43
MAPT P10636 2/20 0.41
MEN1 O00255 1/20 0.41
LMNA P02545 1/20 0.41
KMT2A Q03164 1/20 0.41
NR1I2 O75469 3/20 0.39
OPRM1 P35372 1/20 0.39
DRD3 P35462 1/20 0.39
OPRD1 P41143 1/20 0.39
BCHE P06276 2/20 0.38
ACHE P22303 2/20 0.38
DRD2 P14416 1/20 0.38
SLC6A2 P23975 1/20 0.37
SLC6A4 P31645 1/20 0.37
NR1I3 Q14994 1/20 0.37

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
SCHEMBL9768774 0.95 ALDH1A1 (0.43) ALDH1A1KDM4EMAPTMEN1LMNA
SCHEMBL9768732 0.92 ALDH1A1 (0.44) ALDH1A1KDM4EMAPTMEN1LMNA
Hydrochloric Acid SCHEMBL9768872 0.91 ALDH1A1 (0.43) ALDH1A1KDM4EMAPTMEN1LMNA
SCHEMBL9768706 0.88 MAPT (0.44) ALDH1A1KDM4EMAPTKMT2ASLC6A2
SCHEMBL9768711 0.87 NPC1 (0.45) ALDH1A1KDM4EMAPTMEN1LMNA
SCHEMBL9768826 0.83 MAPT (0.41) ALDH1A1KDM4EMAPTMEN1LMNA
SCHEMBL9768779 0.82 NPC1 (0.45) ALDH1A1KDM4EMAPTMEN1LMNA
SCHEMBL9768718 0.79 NR1I2 (0.46) ALDH1A1MAPTMEN1LMNAKMT2A
SCHEMBL9768790 0.79 NPC1 (0.46) ALDH1A1KDM4EMAPTMEN1LMNA
Hydrochloric Acid SCHEMBL9768729 0.78 MAPT (0.39) ALDH1A1KDM4EMAPTMEN1LMNA

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-5011833-A Antidepressant A. MENARINI INDUSTRIE FARMACEUTICHE RIUNITE (IT) 1991-04-30 US claimed