SCHEMBL5776450

SCHEMBL5776450

CCCCc1ccnc(Nc2cccc3cc4ccccc4cc23)c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK10 P53779 5/20 0.40
TRPV1 Q8NER1 4/20 0.38
RIOK2 Q9BVS4 1/20 0.37
GPR52 Q9Y2T5 1/20 0.36
MAPK8 P45983 3/20 0.36
KDM4E B2RXH2 2/20 0.36
MEN1 O00255 2/20 0.36
ALDH1A1 P00352 2/20 0.36
GAA P10253 2/20 0.36
MAPT P10636 2/20 0.36
KMT2A Q03164 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
LMNA P02545 1/20 0.36
GLA P06280 1/20 0.36
POLB P06746 1/20 0.36
HTT P42858 1/20 0.36
RAB9A P51151 1/20 0.36
RCE1 Q9Y256 1/20 0.36
MME P08473 1/20 0.35
NR3C2 P08235 2/20 0.35

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
SCHEMBL5775211 0.95 MAPK10 (0.38) MAPK10TRPV1RIOK2MAPK8KDM4E
SCHEMBL5774799 0.95 MAPK10 (0.38) MAPK10TRPV1RIOK2MAPK8KDM4E
SCHEMBL5769845 0.95 MAPK10 (0.38) MAPK10TRPV1RIOK2MAPK8KDM4E
SCHEMBL5780372 0.93 MAPK10 (0.41) MAPK10RIOK2GPR52KDM4EMEN1
SCHEMBL5773385 0.87 RIOK2 (0.48) MAPK10RIOK2GPR52KDM4EMEN1
SCHEMBL5750867 0.85 TRPV1 (0.41) MAPK10TRPV1MAPK8KDM4EMEN1
SCHEMBL5772772 0.84 LMNA (0.38) TRPV1RIOK2KDM4EMEN1ALDH1A1
SCHEMBL5750823 0.82 KDM4E (0.37) MAPK10TRPV1RIOK2GPR52KDM4E
SCHEMBL5770717 0.80 RIOK2 (0.44) MAPK10TRPV1RIOK2MAPK8MEN1
SCHEMBL5914010 0.79 MAPT (0.43) TRPV1RIOK2KDM4EMAPT

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