SCHEMBL5748565

SCHEMBL5748565

CCCCCCc1ccnc(Nc2ccccn2)c1

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALOX12 P18054 1/20 0.45
HTT P42858 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
KDM4E B2RXH2 1/20 0.41
MEN1 O00255 1/20 0.41
MAPK10 P53779 1/20 0.41
GFER P55789 1/20 0.41
KMT2A Q03164 1/20 0.41
GRM5 P41594 1/20 0.40
GPR3 P46089 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
LPL P06858 1/20 0.39
LIPG Q9Y5X9 1/20 0.39
NR3C2 P08235 1/20 0.39
ALDH1A1 P00352 1/20 0.39
GAA P10253 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
SCHEMBL5745314 0.87 KDM4E (0.42) ALOX12KDM4EGPR3TDP1L3MBTL1
SCHEMBL5746333 0.87 KDM4E (0.42) ALOX12KDM4EGPR3TDP1L3MBTL1
SCHEMBL5750072 0.87 KDM4E (0.42) ALOX12KDM4EGPR3TDP1L3MBTL1
SCHEMBL5750951 0.86 KCNH3 (0.44) HTTSMN1; SMN2KDM4EMAPK10GPR3
SCHEMBL5749197 0.86 KCNH3 (0.44) HTTSMN1; SMN2KDM4EMAPK10GPR3
SCHEMBL5748767 0.86 KCNH3 (0.44) HTTSMN1; SMN2KDM4EMAPK10GPR3
SCHEMBL5748693 0.82 TLR8 (0.41) HTTSMN1; SMN2KDM4EALDH1A1GAA
SCHEMBL15834054 0.82 NOS3 (0.50) MEN1MAPK10GFERKMT2AGRM5
SCHEMBL5746344 0.81 MME (0.41) SMN1; SMN2KDM4ETDP1L3MBTL1NR3C2
SCHEMBL5779245 0.80 MAPT (0.43) KDM4EGPR3TDP1L3MBTL1

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