SCHEMBL13664744

SCHEMBL13664744

O=C1CCNCCN1c1ccc(Cl)c(F)c1

nearest known ligand 0.48

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 10/20 0.48
SLC6A4 P31645 9/20 0.48
SLC6A3 Q01959 6/20 0.48
ADRB1 P08588 1/20 0.43
HTR6 P50406 3/20 0.41
RAD51 Q06609 1/20 0.40
F10 P00742 2/20 0.40
USP2 O75604 1/20 0.38
CYP11B2 P19099 1/20 0.38
CACNA2D1 P54289 1/20 0.37

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
SCHEMBL7806569 0.82 SLC6A2 (0.49) SLC6A2SLC6A4SLC6A3RAD51
SCHEMBL13664714 0.81 SLC6A2 (0.49) SLC6A2SLC6A4SLC6A3ADRB1HTR6
SCHEMBL31662970 0.79 RAD51 (0.44) SLC6A2SLC6A4SLC6A3RAD51CYP11B2
SCHEMBL13665288 0.78 SLC6A2 (0.76) SLC6A2SLC6A4SLC6A3ADRB1HTR6
SCHEMBL1186845 0.77 ADRB1 (0.71) SLC6A4ADRB1HTR6
SCHEMBL30609657 0.77 ADRB1 (0.71) SLC6A4ADRB1HTR6
SCHEMBL13664742 0.74 MAPT (0.50) SLC6A2SLC6A4SLC6A3ADRB1HTR6
SCHEMBL1583560 0.73 SLC6A2 (0.52) SLC6A2SLC6A4SLC6A3RAD51F10
SCHEMBL8257562 0.72 HTR6 (0.53) SLC6A2SLC6A4SLC6A3HTR6F10
Hydrochloric Acid SCHEMBL1583620 0.72 SLC6A2 (0.54) SLC6A2SLC6A4SLC6A3F10

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