SCHEMBL10891775

SCHEMBL10891775

CC(Nc1ccc(Cl)cc1)C1CCCCN1

nearest known ligand 0.61

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 15/20 0.61
SLC6A4 P31645 15/20 0.61
SLC6A3 Q01959 15/20 0.61

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
SCHEMBL4443897 0.80 TDP1 (0.47) SLC6A2SLC6A4SLC6A3
SCHEMBL4729314 0.73 NR4A2 (0.60) SLC6A2SLC6A4SLC6A3
SCHEMBL6364669 0.72 SLC6A3 (0.44) SLC6A2SLC6A4SLC6A3
SCHEMBL11408759 0.71 SLC6A2 (0.69) SLC6A2SLC6A4SLC6A3
SCHEMBL1549844 0.68 NR4A2 (0.62)
SCHEMBL632912 0.68 TDP1 (0.56) SLC6A2SLC6A4SLC6A3
SCHEMBL4373234 0.68 SLC6A3 (0.51) SLC6A2SLC6A4SLC6A3
SCHEMBL4195895 0.68 ALDH1A1 (0.39) SLC6A2SLC6A4SLC6A3
SCHEMBL4195898 0.68 ALDH1A1 (0.39) SLC6A2SLC6A4SLC6A3
SCHEMBL27805387 0.68 ALDH1A1 (0.39) SLC6A2SLC6A4SLC6A3

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4596891-A PHENYL-N,N'-DIETHYLETHYLENE DIAMINES DUPHAR INTERNATIONAL RESEARCH B.V. (NL) 1986-06-24 US disclosed
US-4286983-A INCLUDING COMPOUNDS OF THE N-PHENYL-N',N'-DIETHYL ALKYLENEDIAMINE TYPE DUPHAR INTERNATIONAL RESEARCH B.V. (NL) 1981-09-01 US disclosed