SCHEMBL860337

SCHEMBL860337

C[AsH][C@H]1CCN(c2ccnc(NCCCO)c2)C1

nearest known ligand 0.59

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
HRH4 Q9H3N8 18/20 0.59
KDM4D Q6B0I6 1/20 0.44
NUDT1 P36639 1/20 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
SCHEMBL860338 1.00 HRH4 (0.59) HRH4KDM4DNUDT1
SCHEMBL1588103 0.85 HRH4 (0.81) HRH4
SCHEMBL19458856 0.85 HRH4 (0.81) HRH4
SCHEMBL860180 0.83 HRH4 (0.50) HRH4
SCHEMBL860179 0.83 HRH4 (0.50) HRH4
SCHEMBL19518769 0.81 HRH4 (0.61) HRH4KDM4DNUDT1
SCHEMBL847268 0.80 HRH4 (0.66) HRH4KDM4DNUDT1
SCHEMBL846839 0.79 HRH4 (0.79) HRH4KDM4DNUDT1
SCHEMBL860177 0.78 HRH4 (0.47) HRH4
SCHEMBL860178 0.78 HRH4 (0.47) HRH4

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-2011524363-A 2011-09-01 JP claimed
EP-2315521-A1 DIAMINO-PYRIDINE, PYRIMIDINE, AND PYRIDAZINE MODULATORS OF THE HISTAMINE H 4 RECEPTOR Janssen Pharmaceutica NV (BE) 2011-05-04 EP claimed
WO-2009152325-A1 DIAMINO-PYRIDINE, PYRIMIDINE, AND PYRIDAZINE MODULATORS OF THE HISTAMINE H4 RECEPTOR JANSSEN PHARMACEUTICA NV (BE) 2009-12-17 WO claimed