SCHEMBL9189986

SCHEMBL9189986

CC(N)C1(CCCN)CCCCC1

nearest known ligand 0.31

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 2/20 0.31
SLC6A3 Q01959 2/20 0.31
SLC6A2 P23975 1/20 0.30

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
SCHEMBL9189870 0.89 GRIN2D (0.32)
SCHEMBL5827757 0.78 SLC6A3 (0.34) SLC6A4SLC6A3SLC6A2
SCHEMBL5827902 0.78 SLC6A3 (0.34) SLC6A4SLC6A3SLC6A2
SCHEMBL38662114 0.74
SCHEMBL21028163 0.73 SLC6A3 (0.34) SLC6A4SLC6A3SLC6A2
SCHEMBL11640562 0.71 OPRM1 (0.37)
SCHEMBL9921963 0.71
SCHEMBL4492198 0.71 DPP4 (0.35) SLC6A4SLC6A3SLC6A2
SCHEMBL25663480 0.71 DPP4 (0.35) SLC6A4SLC6A3SLC6A2
SCHEMBL6519091 0.70

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0530696-B1 Process for the preparation of pentane 1,5-diamines BASF AG (DE) 1995-08-09 EP disclosed
US-5344983-A Selective preparation of linear pentane-1,5-diamines in increased yields BASF AKTIENGESELLSCHAFT (DE) 1994-09-06 US disclosed
EP-0530696-A2 Process for the preparation of pentane 1,5-diamines BASF Aktiengesellschaft (DE) 1993-03-10 EP disclosed