SCHEMBL19831969

SCHEMBL19831969

CC(N)Cc1cccc(F)c1CCN=O

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 2/20 0.36
TAAR1 Q96RJ0 2/20 0.36
MAOA P21397 1/20 0.36
SLC6A4 P31645 1/20 0.36
SLC6A3 Q01959 1/20 0.36
SIGMAR1 Q99720 1/20 0.36
CYP2A6 P11509 1/20 0.36
ADORA2A P29274 1/20 0.36
ADORA1 P30542 1/20 0.36
PNMT P11086 1/20 0.35
AOC3 Q16853 1/20 0.34
HTR2A P28223 1/20 0.33
HTR2C P28335 1/20 0.33
SOS2 Q07890 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
SCHEMBL23640995 0.80 TAAR1 (0.39) SLC6A2TAAR1MAOASLC6A4SLC6A3
SCHEMBL14478256 0.73 SLC6A2 (0.52) SLC6A2TAAR1MAOASLC6A4SLC6A3
SCHEMBL8092360 0.72 SLC6A2 (0.47) SLC6A2TAAR1MAOASLC6A4SLC6A3
SCHEMBL14478267 0.71 TAAR1 (0.50) SLC6A2TAAR1MAOASLC6A4SLC6A3
SCHEMBL3238216 0.71 TAAR1 (0.50) SLC6A2TAAR1MAOASLC6A4SLC6A3
SCHEMBL2563200 0.71 TAAR1 (0.50) SLC6A2TAAR1MAOASLC6A4SLC6A3
SCHEMBL29687549 0.71 TAAR1 (0.50) SLC6A2TAAR1MAOASLC6A4SLC6A3
SCHEMBL19831977 0.71 TAAR1 (0.39) SLC6A2TAAR1MAOASLC6A4SLC6A3
SCHEMBL13692395 0.71 SLC6A2 (0.45) SLC6A2TAAR1MAOASLC6A4SLC6A3
SCHEMBL8977117 0.71 SLC6A2 (0.45) SLC6A2TAAR1MAOASLC6A4SLC6A3

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
WO-2018023072-A2 COMPOUNDS AND COMPOSITIONS AND USES THEREOF SUNOVION PHARMACEUTICALS, INC. (US) 2018-02-01 WO disclosed