SCHEMBL13664863

SCHEMBL13664863

O=C1CNCCCN1c1ccc(Cl)c(Cl)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 15/20 1.00
SLC6A4 P31645 15/20 1.00
SLC6A3 Q01959 12/20 1.00
ADRB1 P08588 1/20 0.49
CTSG P08311 2/20 0.42
CMA1 P23946 2/20 0.42
LMNA P02545 1/20 0.41
MAPT P10636 1/20 0.41
ALOX12 P18054 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41

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
SCHEMBL13664684 0.95 SLC6A2 (0.91) SLC6A2SLC6A4SLC6A3ADRB1CTSG
SCHEMBL13664888 0.88 SLC6A2 (0.79) SLC6A2SLC6A4SLC6A3
SCHEMBL13665288 0.87 SLC6A2 (0.76) SLC6A2SLC6A4SLC6A3ADRB1CTSG
SCHEMBL6431344 0.79 SLC6A2 (0.65) SLC6A2SLC6A4SLC6A3CTSGCMA1
SCHEMBL26774776 0.79 SLC6A2 (0.65) SLC6A2SLC6A4SLC6A3ADRB1
SCHEMBL13664717 0.78 SLC6A2 (0.63) SLC6A2SLC6A4SLC6A3
SCHEMBL13664710 0.78 SLC6A2 (0.63) SLC6A2SLC6A4SLC6A3MAPTL3MBTL1
SCHEMBL5480292 0.76 SLC6A2 (0.60) SLC6A2SLC6A4SLC6A3ADRB1MAPT
SCHEMBL13664737 0.75 SLC6A2 (0.60) SLC6A2SLC6A4SLC6A3ADRB1MAPT
SCHEMBL11817169 0.75 SLC6A2 (0.59) SLC6A2SLC6A4SLC6A3ADRB1CTSG

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-2009119528-A1 HETEROCYCLIC COMPOUND 武田薬品工業株式会社 (JP) 2009-10-01 WO disclosed