SCHEMBL27662575

SCHEMBL27662575

CCn1ncc2c(-c3ccc(Cl)s3)c(OC)c(-c3ccccc3)nc21

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 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 2/20 0.38
HSD17B10 Q99714 2/20 0.38
MAPT P10636 1/20 0.38
HPGD P15428 1/20 0.38
SIGMAR1 Q99720 1/20 0.34
ADORA3 P0DMS8 2/20 0.34
ADORA1 P30542 2/20 0.34
ADORA2A P29274 2/20 0.34
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
PDGFRB P09619 1/20 0.33
PDGFRA P16234 1/20 0.33
USP2 O75604 1/20 0.33

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
SCHEMBL27662576 0.84 KDM4E (0.38) KDM4EMAPK1CASP1CASP7ATM
SCHEMBL4778122 0.83 KDM4E (0.37) KDM4EMAPK1CASP1CASP7ATM
SCHEMBL4779619 0.82 MAPT (0.45) KDM4EMAPK1L3MBTL1ALDH1A1HSD17B10
SCHEMBL27662539 0.80 KDM4E (0.38) KDM4EMAPK1CASP1CASP7ATM
SCHEMBL27682223 0.80 MAPT (0.38) KDM4EMAPK1CASP1CASP7ATM
SCHEMBL27662582 0.80 MAT2A (0.38) SIGMAR1ADORA3ADORA1ADORA2APDGFRB
SCHEMBL4769606 0.79 HPGD (0.34) KDM4EMAPK1CASP1CASP7ATM
SCHEMBL4769613 0.79 HPGD (0.34) KDM4EMAPK1CASP1CASP7ATM
SCHEMBL27682168 0.79 TBXAS1 (0.42) KDM4EMAPK1CASP1CASP7ATM
SCHEMBL27682164 0.79 ADORA2A (0.41) 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 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