SCHEMBL5504656

SCHEMBL5504656

CC1CCCN1CC1CCNCC1

nearest known ligand 0.44

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
GBA1 P04062 1/20 0.44
HRH3 Q9Y5N1 18/20 0.37
PLAT P00750 1/20 0.36

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
Hydrochloric Acid SCHEMBL4387922 0.98 GBA1 (0.42) GBA1HRH3PLAT
SCHEMBL13660908 0.94 GBA1 (0.42) GBA1
SCHEMBL3005092 0.89 SLC6A1 (0.35) GBA1HRH3PLAT
SCHEMBL3713667 0.89 SLC6A1 (0.35) GBA1HRH3PLAT
SCHEMBL3005090 0.89 SLC6A1 (0.35) GBA1HRH3PLAT
SCHEMBL1787100 0.86 HRH3 (0.42) HRH3
SCHEMBL22852502 0.86 HRH3 (0.42) HRH3
SCHEMBL4966546 0.84 ACHE (0.42) HRH3
SCHEMBL10998848 0.84 ACHE (0.47) GBA1HRH3
SCHEMBL4966539 0.84 ACHE (0.42) 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
EP-1847530-A1 DIAMINE DERIVATIVE KYOWA HAKKO KOGYO CO., LTD. (JP) 2007-10-24 EP disclosed