SCHEMBL1729206

SCHEMBL1729206

CNC(CN(CC=O)C(=O)O)N1CCN(c2ccc(-c3cccc(OC(F)(F)F)c3)cn2)CC1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A7 Q99884 1/20 0.42
PRMT5 O14744 1/20 0.39
WDR77 Q9BQA1 1/20 0.39
PIM1 P11309 2/20 0.39
PDE4A P27815 1/20 0.38
PDE4B Q07343 1/20 0.38
PDE4D Q08499 1/20 0.38
CTSA P10619 1/20 0.38
DYRK1A Q13627 1/20 0.38
EGLN1 Q9GZT9 1/20 0.37
KDM4E B2RXH2 1/20 0.37
LMNA P02545 1/20 0.37
MAPK1 P28482 1/20 0.37
HTT P42858 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
HSD17B10 Q99714 1/20 0.37
NR1H4 Q96RI1 1/20 0.37
DHODH Q02127 1/20 0.36
WNT3A P56704 1/20 0.36
MME P08473 1/20 0.36

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
SCHEMBL1730220 0.92 EGLN1 (0.45) PRMT5WDR77PDE4APDE4BPDE4D
SCHEMBL1728061 0.91 CACNA1G (0.38)
SCHEMBL1728823 0.88 SLC6A7 (0.44) SLC6A7PRMT5WDR77PIM1PDE4A
SCHEMBL1727878 0.87 PDE4A (0.39) SLC6A7PIM1PDE4APDE4BPDE4D
SCHEMBL1729048 0.84 EGLN1 (0.41) SLC6A7EGLN1LMNAMAPK1HSD17B10
SCHEMBL1728917 0.84 SLC6A7 (0.40) SLC6A7PDE4APDE4BPDE4DCTSA
SCHEMBL1728999 0.82 MGLL (0.41) EGLN1MGLLSCN9A
SCHEMBL1729333 0.82 SUCNR1 (0.40) SCN9A
SCHEMBL1729088 0.80 PANK3 (0.39) SLC6A7EGLN1
SCHEMBL1729020 0.79 SCN10A (0.38) MGLL

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
EP-1633735-B1 DERIVATIVES OF PIPERIDINYL- AND PIPERAZINYL-ALKYL CARBAMATES, PREPARATION METHODS THEREOF AND APPLICATION OF SAME IN THERAPEUTICS SANOFI SA (FR) 2011-11-30 EP claimed