SCHEMBL5212436

SCHEMBL5212436

O=C(c1ccc(N2CCC(OC3CCN(C4CCC4)CC3)CC2)cn1)N1CCCCC1

nearest known ligand 0.59

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 16/20 0.59
L3MBTL3 Q96JM7 3/20 0.52
L3MBTL1 Q9Y468 3/20 0.52
KCNH2 Q12809 1/20 0.50
MBTD1 Q05BQ5 1/20 0.46
TP53BP1 Q12888 1/20 0.46
L3MBTL4 Q8NA19 1/20 0.46
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44

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
SCHEMBL5210985 0.91 HRH3 (0.56) HRH3L3MBTL3L3MBTL1KCNH2MBTD1
SCHEMBL5212817 0.86 HRH3 (0.61) HRH3
SCHEMBL5210105 0.85 HRH3 (0.60) HRH3
SCHEMBL14431499 0.85 HRH3 (0.75) HRH3
SCHEMBL5208546 0.84 HRH3 (0.52) HRH3L3MBTL3L3MBTL1MBTD1TP53BP1
SCHEMBL5213574 0.84 HRH3 (0.58) HRH3
SCHEMBL5212856 0.83 L3MBTL3 (0.68) HRH3L3MBTL3L3MBTL1MBTD1TP53BP1
SCHEMBL5212438 0.83 HRH3 (0.60) HRH3KCNH2
SCHEMBL5210560 0.83 HRH3 (0.59) HRH3
SCHEMBL5211397 0.83 HRH3 (0.57) 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-1646620-B1 SUBSTITUTED PIPERIDINES AS HISTAMINE H3 RECEPTOR LIGANDS GLAXO GROUP LTD (GB) 2007-08-15 EP claimed