SCHEMBL166435

SCHEMBL166435

CCCN1CCc2nc(OC3CCN(C4CCC4)CC3)oc2C1

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 18/20 0.33
ADRA1A P35348 2/20 0.32
KCNH2 Q12809 2/20 0.32
CYP3A4 P08684 1/20 0.32
TSHR P16473 1/20 0.32
HSD17B10 Q99714 1/20 0.32

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
SCHEMBL166356 0.80 GPR6 (0.38) HRH3
SCHEMBL165592 0.77 HRH3 (0.45) HRH3
SCHEMBL165543 0.75 HRH3 (0.37) HRH3
SCHEMBL165665 0.74 HRH3 (0.43) HRH3KCNH2
SCHEMBL164928 0.69 HRH3 (0.39) HRH3
SCHEMBL175797 0.67 HRH3 (0.40) HRH3
SCHEMBL176068 0.67 HRH3 (0.35) HRH3ADRA1AKCNH2
SCHEMBL174556 0.67 HRH3 (0.39) HRH3
SCHEMBL164398 0.67 HRH3 (0.34) HRH3ADRA1AKCNH2
SCHEMBL3400193 0.65 DRD3 (0.40) HRH3KCNH2

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
EP-2611444-A1 HETEROCYCLYL COMPOUNDS AS HISTAMINE H3 RECEPTOR LIGANDS Suven Life Sciences Limited (IN) 2013-07-10 EP disclosed
WO-2012029070-A1 HETEROCYCLYL COMPOUNDS AS HISTAMINE H3 RECEPTOR LIGANDS SUVEN LIFE SCIENCES LIMITED (IN) 2012-03-08 WO disclosed