SCHEMBL5773385

SCHEMBL5773385

CCc1ccnc(Nc2cccc3cc4ccccc4cc23)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RIOK2 Q9BVS4 1/20 0.48
MAPK10 P53779 6/20 0.43
NOS3 P29474 1/20 0.41
NOS1 P29475 1/20 0.41
NOS2 P35228 1/20 0.41
KMT2A Q03164 5/20 0.40
MEN1 O00255 4/20 0.40
CYP1A2 P05177 1/20 0.39
CYP2A6 P11509 1/20 0.39
GPR52 Q9Y2T5 3/20 0.39
GAA P10253 4/20 0.38
MAPT P10636 3/20 0.38
KDM4E B2RXH2 2/20 0.38
ALDH1A1 P00352 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
MAPKAPK2 P49137 1/20 0.38
POLB P06746 2/20 0.37
NTSR1 P30989 1/20 0.37
RAD52 P43351 1/20 0.37
RECQL P46063 1/20 0.37

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
SCHEMBL5780372 0.90 MAPK10 (0.41) RIOK2MAPK10KMT2AMEN1GPR52
SCHEMBL5776450 0.87 MAPK10 (0.40) RIOK2MAPK10KMT2AMEN1GPR52
SCHEMBL5775211 0.85 MAPK10 (0.38) RIOK2MAPK10MAPTKDM4E
SCHEMBL5769845 0.85 MAPK10 (0.38) RIOK2MAPK10MAPTKDM4E
SCHEMBL5774799 0.85 MAPK10 (0.38) RIOK2MAPK10MAPTKDM4E
SCHEMBL5775894 0.82 RIOK2 (0.48) RIOK2MAPK10NOS3NOS1NOS2
SCHEMBL5778360 0.82 KMT2A (0.49) RIOK2MAPK10NOS2KMT2AMEN1
SCHEMBL5748108 0.80 RIOK2 (0.44) RIOK2MAPK10NOS3NOS1NOS2
SCHEMBL5776205 0.78 KMT2A (0.61) MAPK10KMT2AMEN1GAAMAPT
SCHEMBL5771765 0.78 RIOK2 (0.56) RIOK2MAPK10NOS3NOS1NOS2

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
US-20060293503-A1 Polyaminopyridines and method for producing same SUMITOMO SEIKA CHEMICALS CO., LTD (JP) 2006-12-28 US disclosed
EP-1669390-A1 POLYAMINOPYRIDINES AND METHOD FOR PRODUCING SAME SUMITOMO SEIKA CHEMICALS CO., LTD. (JP) 2006-06-14 EP disclosed