SCHEMBL2550299

SCHEMBL2550299

CC1Cc2ccc(-c3ccn(C)n3)cc2CN1c1cc(Cl)nc(N)n1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 1/20 0.36
PIP5K1C O60331 1/20 0.36
PIK3CA P42336 1/20 0.36
PIK3CB P42338 1/20 0.36
PI4KA P42356 1/20 0.36
PIK3CG P48736 1/20 0.36
PI4KB Q9UBF8 1/20 0.36
KEAP1 Q14145 1/20 0.36
HRH4 Q9H3N8 2/20 0.35
MAPT P10636 2/20 0.34
CYP1A2 P05177 2/20 0.34
CYP2D6 P10635 1/20 0.34
LMNA P02545 3/20 0.34
HTT P42858 2/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
S1PR2 O95136 1/20 0.34
ALOX12 P18054 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
KMT2A Q03164 1/20 0.33
CYP3A4 P08684 1/20 0.33

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
SCHEMBL2550992 0.86 HRH4 (0.47) HRH4
SCHEMBL2513099 0.84 KDM1A (0.41) PIK3CDPIK3CAPIK3CBPI4KAPIK3CG
SCHEMBL2491275 0.79 MAPT (0.39) HRH4MAPTCYP1A2CYP2D6LMNA
SCHEMBL2512926 0.76 HRH4 (0.43) HRH4
SCHEMBL13266839 0.76 HRH4 (0.42) HRH4
SCHEMBL2991908 0.75 HRH4 (0.41) HRH4
SCHEMBL2514480 0.74 HRH4 (0.40) HRH4
SCHEMBL2511146 0.74 HRH4 (0.44) HRH4
SCHEMBL15254277 0.74 HRH4 (0.40) HRH4
SCHEMBL2997637 0.74 HRH4 (0.43) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2379523-A1 4, 6-DISUBSTITUTED 2-AMINO-PYRIMIDINES AS HISTAMINE H4 RECEPTOR MODULATORS Incyte Corporation (US) 2011-10-26 EP disclosed
WO-2010075270-A1 4, 6-DISUBSTITUTED 2-AMINO-PYRIMIDINES AS HISTAMINE H4 RECEPTOR MODULATORS INCYTE CORPORATION (US) 2010-07-01 WO disclosed