SCHEMBL28067947

SCHEMBL28067947

CCCC(CCC(CCCCCC(CCC(CC)N1CCCCCCCCCCC1)N1CCCCCCCCCCC1)N1CCCCCCCCCCC1)N1CCCCCCCCCCC1

nearest known ligand 0.37

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 2/20 0.33
SLC6A3 Q01959 7/20 0.31
SLC6A2 P23975 5/20 0.31
SLC6A4 P31645 4/20 0.31

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
SCHEMBL27801806 0.89 HRH3 (0.37) HRH3
SCHEMBL27825382 0.89 HRH3 (0.37) HRH3
SCHEMBL27531714 0.89 HRH3 (0.37) HRH3
SCHEMBL29106969 0.89 HRH3 (0.37) HRH3
SCHEMBL4275497 0.89 HRH3 (0.37) HRH3
SCHEMBL23733430 0.89 HRH3 (0.37) HRH3
SCHEMBL27396815 0.89 HRH3 (0.37) HRH3
SCHEMBL27827097 0.89 HRH3 (0.37) HRH3
SCHEMBL4268661 0.89 HRH3 (0.37) HRH3
SCHEMBL27321157 0.89 HRH3 (0.37) HRH3

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
CN-104151367-B A kind of Rare Earth Lanthanum complex and synthetic method thereof BEIJING NORMAL UNIVERSITY (CN) 2016-05-04 CN disclosed