SCHEMBL5367661

SCHEMBL5367661

CCn1ncc2c(-c3cncc(Cl)c3)c(CO)c(-c3ccccc3)nc21

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 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
MAPT P10636 2/20 0.38
ALDH1A1 P00352 2/20 0.38
HSD17B10 Q99714 2/20 0.38
HPGD P15428 1/20 0.38
ADORA1 P30542 3/20 0.36
ADORA3 P0DMS8 1/20 0.36
ADORA2A P29274 1/20 0.36
MDM2 Q00987 1/20 0.35
NR1H3 Q13133 1/20 0.35
PSEN1 P49768 1/20 0.35
PSEN2 P49810 1/20 0.35
APH1B Q8WW43 1/20 0.35
NCSTN Q92542 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
SCHEMBL27682184 0.88 KDM4E (0.36) KDM4EMAPK1CASP1CASP7ATM
SCHEMBL27682201 0.88 KDM4E (0.36) KDM4EMAPK1CASP1CASP7ATM
SCHEMBL4778930 0.87 KDM4E (0.43) KDM4EMAPK1CASP1CASP7ATM
SCHEMBL27682170 0.85 TBXAS1 (0.43) KDM4EMAPK1CASP1CASP7ATM
SCHEMBL27682223 0.84 MAPT (0.38) KDM4EMAPK1CASP1CASP7ATM
SCHEMBL4774431 0.84 KDM4E (0.37) KDM4EMAPK1CASP1CASP7ATM
SCHEMBL4776504 0.82 KDM4E (0.47) KDM4EMAPK1MAPTALDH1A1HSD17B10
SCHEMBL27682165 0.82 ADORA2A (0.41) KDM4EMAPK1CASP1CASP7ATM
SCHEMBL27662635 0.82 PRKAA2 (0.36) ADORA1ADORA3ADORA2AMDM2PSEN1
SCHEMBL4770239 0.82 KDM4E (0.39) KDM4EMAPK1CASP1CASP7ATM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1763528-A1 PYRAZOLOPYRIDINE DERIVATIVES Astellas Pharma Inc. (JP) 2007-03-21 EP claimed
WO-2006004188-A1 PYRAZOLOPYRIDINE DERIVATIVES ASTELLAS PHARMA INC. (JP) 2006-01-12 WO claimed
CN-1980927-A Pyrazolopyridine derivatives ASTELLAS PHARMA INC (JP) 2007-06-13 CN disclosed