SCHEMBL17976909

SCHEMBL17976909

O=C(C(I)=Cc1ccc(OC2CCN(C3CCC3)CC2)nc1)N1CCCCC1

nearest known ligand 0.46

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 17/20 0.46
KCNH2 Q12809 1/20 0.46
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
NAMPT P43490 2/20 0.39

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
SCHEMBL15571272 0.82 HRH3 (0.49) HRH3KCNH2MEN1KMT2A
SCHEMBL17976901 0.82 HRH3 (0.49) HRH3KCNH2MEN1KMT2A
SCHEMBL2004014 0.79 HRH3 (0.58) HRH3KCNH2
SCHEMBL2008698 0.76 HRH3 (0.54) HRH3KCNH2
SCHEMBL17976916 0.73 HRH3 (0.47) HRH3KCNH2
SCHEMBL15571318 0.73 HRH3 (0.47) HRH3KCNH2
SCHEMBL12485580 0.71 HRH3 (0.72) HRH3
SCHEMBL738339 0.69 HRH3 (0.57) HRH3KCNH2
SCHEMBL2005954 0.69 HRH3 (0.57) HRH3KCNH2
SCHEMBL16702162 0.69 NAMPT (0.45) NAMPT

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-2888243-B1 ACRYLAMIDE COMPOUNDS AS HISTAMINE H3 RECEPTOR LIGANDS SUVEN LIFE SCIENCES LTD (IN) 2016-08-17 EP disclosed