SCHEMBL4300322

SCHEMBL4300322

Cc1c(F)ccc2[nH]c(-c3ccc4c(ccn4C(CCC4CCN(C)CC4)C4CCN(C)CC4)c3)nc12

nearest known ligand 0.48

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
HRH4 Q9H3N8 18/20 0.48
KCNH2 Q12809 2/20 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
SCHEMBL4008717 0.89 HRH4 (0.51) HRH4
SCHEMBL4440410 0.83 HRH4 (0.48) HRH4
SCHEMBL604409 0.82 HRH4 (0.55) HRH4KCNH2
SCHEMBL602354 0.77 HRH4 (0.57) HRH4KCNH2
SCHEMBL602283 0.75 HRH4 (0.55) HRH4KCNH2
SCHEMBL4436591 0.75 HRH4 (0.40) HRH4
SCHEMBL605460 0.74 HRH4 (0.56) HRH4KCNH2
SCHEMBL4169731 0.74 HRH4 (0.46) HRH4KCNH2
SCHEMBL605371 0.74 HRH4 (0.57) HRH4KCNH2
SCHEMBL605607 0.73 HRH4 (0.53) HRH4KCNH2

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
WO-2009079001-A1 BICYCLIC HETEROARYL-SUBSTITUTED IMIDAZOLES AS MODULATORS OF THE HISTAMINE H4 RECEPTOR JANSSEN PHARMACEUTICA N.V. (BE) 2009-06-25 WO disclosed