SCHEMBL13664778

SCHEMBL13664778

CC[C@H]1NCCCN(c2ccc(Cl)c(Cl)c2)C1=O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 17/20 1.00
SLC6A4 P31645 17/20 1.00
SLC6A3 Q01959 13/20 1.00
HTR1A P08908 1/20 0.41
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
BCL2A1 Q16548 2/20 0.40

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
SCHEMBL13664680 1.00 SLC6A2 (1.00) SLC6A2SLC6A4SLC6A3HTR1ANPC1
SCHEMBL13664892 0.90 SLC6A2 (0.82) SLC6A2SLC6A4SLC6A3HTR1ABCL2A1
SCHEMBL13665273 0.88 SLC6A2 (0.78) SLC6A2SLC6A4SLC6A3HTR1ABCL2A1
SCHEMBL13664780 0.87 SLC6A2 (0.77) SLC6A2SLC6A4SLC6A3HTR1A
SCHEMBL13665280 0.86 SLC6A2 (0.76) SLC6A2SLC6A4SLC6A3HTR1ABCL2A1
SCHEMBL13664674 0.83 SLC6A2 (1.00) SLC6A2SLC6A4SLC6A3BCL2A1
SCHEMBL13664679 0.81 SLC6A2 (1.00) SLC6A2SLC6A4SLC6A3
SCHEMBL13664720 0.80 SLC6A2 (0.70) SLC6A2SLC6A4SLC6A3BCL2A1
SCHEMBL13664779 0.80 SLC6A2 (0.70) SLC6A2SLC6A4SLC6A3BCL2A1
SCHEMBL8531016 0.76 SLC6A4 (0.62) SLC6A2SLC6A4SLC6A3HTR1A

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