SCHEMBL17010751

SCHEMBL17010751

CC(C(=O)N(C)C)N1CCCCC1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 1/20 0.41
SLC6A2 P23975 6/20 0.40
CHRNB4 P30926 6/20 0.40
CHRNA3 P32297 6/20 0.40
SLC6A3 Q01959 6/20 0.40
CHRNB2 P17787 5/20 0.40
CHRNA4 P43681 5/20 0.40
CHRNA1 P02708 4/20 0.40
CHRNG P07510 4/20 0.40
CHRNB1 P11230 4/20 0.40
CHRND Q07001 4/20 0.40
ALDH1A1 P00352 3/20 0.39
GAA P10253 2/20 0.39
KDM4E B2RXH2 1/20 0.39
SLC6A4 P31645 1/20 0.39
ACHE P22303 1/20 0.38
ATM Q13315 1/20 0.38
NPC1 O15118 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.36
FDPS P14324 2/20 0.35

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
SCHEMBL9765845 0.80 FDPS (0.37) MAOBALDH1A1GAAACHENPC1
SCHEMBL15615636 0.79 MAPT (0.47) ALDH1A1GAASMN1; SMN2KMT2A
SCHEMBL27992779 0.78 SLC6A3 (0.42) SLC6A2SLC6A3SLC6A4
SCHEMBL27647452 0.77 MAOB (0.46) MAOBSLC6A2CHRNB4CHRNA3SLC6A3
SCHEMBL10939615 0.75 DPP7 (0.45) MAOBSLC6A2CHRNB4CHRNA3SLC6A3
SCHEMBL12462690 0.75 MAOB (0.44) MAOBSLC6A2CHRNB4CHRNA3SLC6A3
SCHEMBL12937998 0.75 MAOB (0.44) MAOBSLC6A2CHRNB4CHRNA3SLC6A3
Hydrochloric Acid SCHEMBL11682964 0.75 MAOB (0.44) MAOBSLC6A2CHRNB4CHRNA3SLC6A3
SCHEMBL4938808 0.75 DPP7 (0.45) MAOBSLC6A2CHRNB4CHRNA3SLC6A3
SCHEMBL14850491 0.75 MAOB (0.44) MAOBSLC6A2CHRNB4CHRNA3SLC6A3

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
EP-3105219-A1 CYCLOPROPYLAMINES AS LSD1 INHIBITORS Incyte Corporation (US) 2016-12-21 EP claimed
WO-2015123408-A1 CYCLOPROPYLAMINES AS LSD1 INHIBITORS INCYTE CORPORATION (US) 2015-08-20 WO claimed