SCHEMBL4257928

SCHEMBL4257928

Cc1cccc2c1nc(-c1ccc(N(CCCC3CCN(C)CC3)C(C)C)nc1)n2C

nearest known ligand 0.43

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
NPY1R P25929 17/20 0.43
HRH4 Q9H3N8 1/20 0.38
PIK3CA P42336 1/20 0.33
MTOR P42345 1/20 0.33
PIK3CD O00329 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
SCHEMBL3476359 0.76 HRH4 (0.50) HRH4
SCHEMBL3476796 0.73 NMT1 (0.35)
SCHEMBL3475980 0.73 HRH4 (0.56) HRH4
SCHEMBL4258986 0.68 NPC1 (0.43) NPY1RHRH4
SCHEMBL13183868 0.64 HRH4 (0.51) NPY1RHRH4
SCHEMBL3476481 0.64 HRH4 (0.52) HRH4
SCHEMBL3476444 0.63 HRH4 (0.55) HRH4
SCHEMBL604528 0.62 HRH4 (0.58) NPY1RHRH4
SCHEMBL3475562 0.61 HRH4 (0.57) HRH4
SCHEMBL2566023 0.61 NPY1R (0.52) NPY1RHRH4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-2009532367-A 2009-09-10 JP claimed
EP-2004188-A4 BENZOIMIDAZOL-2-YL PYRIDINES AS MODULATORS OF THE HISTAMINE H4 RECEPTOR JANSSEN PHARMACEUTICA NV (BE) 2009-04-22 EP claimed
EP-2004188-A2 BENZOIMIDAZOL-2-YL PYRIDINES AS MODULATORS OF THE HISTAMINE H4 RECEPTOR JANSSEN PHARMACEUTICA N.V. (BE) 2008-12-24 EP claimed
WO-2007117400-A2 BENZOIMIDAZOL-2-YL PYRIDINES AS MODULATORS OF THE HISTAMINE H4 RECEPTOR JANSSEN PHARMACEUTICA N.V. (BE) 2007-10-18 WO claimed