SCHEMBL5774799

SCHEMBL5774799

CCCCCCCCCCc1ccnc(Nc2cccc3cc4ccccc4cc23)c1

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAPK10 P53779 2/20 0.38
MAPT P10636 1/20 0.38
TRPV1 Q8NER1 6/20 0.38
PPARG P37231 1/20 0.37
PPARA Q07869 1/20 0.37
MAPK8 P45983 1/20 0.36
RIOK2 Q9BVS4 1/20 0.36
KDM4E B2RXH2 1/20 0.36
LPL P06858 1/20 0.36
LIPG Q9Y5X9 1/20 0.36
KCNH2 Q12809 1/20 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 1.00 MAPK10 (0.38) MAPK10MAPTTRPV1PPARGPPARA
SCHEMBL5769845 1.00 MAPK10 (0.38) MAPK10MAPTTRPV1PPARGPPARA
SCHEMBL5776450 0.95 MAPK10 (0.40) MAPK10MAPTTRPV1MAPK8RIOK2
SCHEMBL5750867 0.91 TRPV1 (0.41) MAPK10MAPTTRPV1MAPK8KDM4E
SCHEMBL5780372 0.90 MAPK10 (0.41) MAPK10MAPTRIOK2KDM4E
SCHEMBL5773385 0.85 RIOK2 (0.48) MAPK10MAPTRIOK2KDM4E
SCHEMBL5779245 0.84 MAPT (0.43) MAPTTRPV1RIOK2KDM4E
SCHEMBL5914010 0.84 MAPT (0.43) MAPTTRPV1RIOK2KDM4E
SCHEMBL5775624 0.84 MAPT (0.43) MAPTTRPV1RIOK2KDM4E
SCHEMBL5748751 0.83 KDM4E (0.36) MAPTTRPV1PPARGPPARARIOK2

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