SCHEMBL5780372

SCHEMBL5780372

CCCc1ccnc(Nc2cccc3cc4ccccc4cc23)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK10 P53779 6/20 0.41
RIOK2 Q9BVS4 1/20 0.39
GPR52 Q9Y2T5 2/20 0.38
KMT2A Q03164 4/20 0.37
GAA P10253 3/20 0.37
MAPT P10636 3/20 0.37
MEN1 O00255 3/20 0.37
KDM4E B2RXH2 2/20 0.37
ALDH1A1 P00352 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
POLB P06746 2/20 0.37
LMNA P02545 1/20 0.37
GLA P06280 1/20 0.37
HTT P42858 1/20 0.37
RAB9A P51151 1/20 0.37
RCE1 Q9Y256 1/20 0.37
NR3C2 P08235 4/20 0.36
GSK3A P49840 1/20 0.36
GSK3B P49841 1/20 0.36
ACVR1 Q04771 1/20 0.36

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
SCHEMBL5776450 0.93 MAPK10 (0.40) MAPK10RIOK2GPR52KMT2AGAA
SCHEMBL5769845 0.90 MAPK10 (0.38) MAPK10RIOK2MAPTKDM4E
SCHEMBL5774799 0.90 MAPK10 (0.38) MAPK10RIOK2MAPTKDM4E
SCHEMBL5775211 0.90 MAPK10 (0.38) MAPK10RIOK2MAPTKDM4E
SCHEMBL5773385 0.90 RIOK2 (0.48) MAPK10RIOK2GPR52KMT2AGAA
SCHEMBL5770617 0.83 RIOK2 (0.38) MAPK10RIOK2KMT2AGAAMAPT
SCHEMBL5750843 0.81 ALDH1A1 (0.39) MAPK10RIOK2GPR52KMT2AMAPT
SCHEMBL5750867 0.80 TRPV1 (0.41) MAPK10KMT2AMAPTMEN1KDM4E
SCHEMBL5778360 0.80 KMT2A (0.49) MAPK10RIOK2KMT2AMEN1POLB
SCHEMBL5778696 0.79 RIOK2 (0.45) MAPK10RIOK2KMT2AMAPTMEN1

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