SCHEMBL27682170

SCHEMBL27682170

CCn1ncc2c(-c3cccnc3)c(CO)c(-c3ccccc3)nc21

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TBXAS1 P24557 1/20 0.43
KDM4E B2RXH2 3/20 0.38
MAPT P10636 2/20 0.38
MAPK1 P28482 2/20 0.38
CASP1 P29466 2/20 0.38
CASP7 P55210 2/20 0.38
ATM Q13315 2/20 0.38
TDP1 Q9NUW8 2/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
ALDH1A1 P00352 1/20 0.38
HPGD P15428 1/20 0.38
HSD17B10 Q99714 1/20 0.38
GAA P10253 1/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
PDE4A P27815 6/20 0.36
PDE4B Q07343 6/20 0.36
PDE4C Q08493 6/20 0.36
PDE4D Q08499 6/20 0.36
PDE5A O76074 4/20 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
SCHEMBL4778930 0.91 KDM4E (0.43) KDM4EMAPTMAPK1CASP1CASP7
SCHEMBL4776084 0.86 TBXAS1 (0.42) TBXAS1KDM4EMAPTMAPK1CASP1
SCHEMBL27682184 0.86 KDM4E (0.36) KDM4EMAPTMAPK1CASP1CASP7
SCHEMBL27682201 0.85 KDM4E (0.36) TBXAS1KDM4EMAPTMAPK1CASP1
SCHEMBL5367661 0.85 KDM4E (0.38) KDM4EMAPTMAPK1CASP1CASP7
SCHEMBL4770239 0.84 KDM4E (0.39) KDM4EMAPTMAPK1CASP1CASP7
SCHEMBL27682168 0.83 TBXAS1 (0.42) TBXAS1KDM4EMAPTMAPK1CASP1
SCHEMBL4777489 0.82 TBXAS1 (0.44) TBXAS1KDM4EMAPTMAPK1CASP1
SCHEMBL4775027 0.82 MEN1 (0.48) TBXAS1KDM4EL3MBTL1GAAMEN1
SCHEMBL27682165 0.82 ADORA2A (0.41) KDM4EMAPTMAPK1CASP1CASP7

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1980927-A Pyrazolopyridine derivatives ASTELLAS PHARMA INC (JP) 2007-06-13 CN disclosed