SCHEMBL5502808

SCHEMBL5502808

CC1CCCN(CCN2CCN(CCCN3CCC[C@@H]3C)C2)C1

nearest known ligand 0.46

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 15/20 0.40
MAOB P27338 2/20 0.38
HRH2 P25021 1/20 0.38
HRH1 P35367 1/20 0.38
HTR7 P34969 1/20 0.38
KDM4E B2RXH2 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
SCHEMBL5505204 0.98 HRH3 (0.41) HRH3MAOBHRH2HRH1HTR7
SCHEMBL5501716 0.88 HRH3 (0.36) HRH3
SCHEMBL5502177 0.88 HRH3 (0.47) HRH3
SCHEMBL5505804 0.88 HRH3 (0.43) HRH3
SCHEMBL5506426 0.88 HRH3 (0.43) HRH3
SCHEMBL5505526 0.88 HRH3 (0.43) HRH3
SCHEMBL5508034 0.87 HRH3 (0.44) HRH3
SCHEMBL5502049 0.87 HRH3 (0.37) HRH3
SCHEMBL5507035 0.86 HRH3 (0.45) HRH3
SCHEMBL5508661 0.84 HRH3 (0.50) 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