SCHEMBL5779245

SCHEMBL5779245

CCCCCCCCc1ccnc(Nc2c3ccccc3cc3ccccc23)c1

nearest known ligand 0.43

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.43
KDM4E B2RXH2 1/20 0.38
TRPV1 Q8NER1 5/20 0.37
TLR7 Q9NYK1 1/20 0.36
RORA P35398 1/20 0.36
RORC P51449 1/20 0.36
RORB Q92753 1/20 0.36
GPR3 P46089 1/20 0.36
RIOK2 Q9BVS4 1/20 0.36
TDP1 Q9NUW8 1/20 0.35
L3MBTL1 Q9Y468 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
SCHEMBL5914010 1.00 MAPT (0.43) MAPTKDM4ETRPV1TLR7RORA
SCHEMBL5775624 1.00 MAPT (0.43) MAPTKDM4ETRPV1TLR7RORA
SCHEMBL5772772 0.95 LMNA (0.38) MAPTKDM4ETRPV1RIOK2TDP1
SCHEMBL5770617 0.90 RIOK2 (0.38) MAPTKDM4ERIOK2
SCHEMBL5774799 0.84 MAPK10 (0.38) MAPTKDM4ETRPV1RIOK2
SCHEMBL5769845 0.84 MAPK10 (0.38) MAPTKDM4ETRPV1RIOK2
SCHEMBL5775211 0.84 MAPK10 (0.38) MAPTKDM4ETRPV1RIOK2
SCHEMBL5775894 0.84 RIOK2 (0.48) MAPTKDM4ERIOK2L3MBTL1
SCHEMBL5750867 0.84 TRPV1 (0.41) MAPTKDM4ETRPV1RORARORC
SCHEMBL5773999 0.81 RIOK2 (0.42) MAPTKDM4ETRPV1RIOK2

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