SCHEMBL7963744

SCHEMBL7963744

O=C(O)c1cn([C@@H]2CC[C@@H](O)C2)c2ncccc2c1=O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.46
TOP2A P11388 4/20 0.42
TOP2B Q02880 4/20 0.42
PIK3CG P48736 1/20 0.41
ABL1 P00519 1/20 0.41
EGFR P00533 1/20 0.41
ABL2 P42684 1/20 0.41
GSK3B P49841 2/20 0.40
DPP4 P27487 1/20 0.39
KDM6B O15054 1/20 0.39
KDM6A O15550 1/20 0.39
TET3 O43151 1/20 0.39
KDM4A O75164 1/20 0.39
KDM4B O94953 1/20 0.39
KDM5C P41229 1/20 0.39
KDM4D Q6B0I6 1/20 0.39
TET2 Q6N021 1/20 0.39
ALKBH5 Q6P6C2 1/20 0.39
TET1 Q8NFU7 1/20 0.39
FTO Q9C0B1 1/20 0.39

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
SCHEMBL7963124 0.93 KDM4E (0.51) KDM4ETOP2ATOP2BPIK3CGGSK3B
SCHEMBL7963122 0.93 KDM4E (0.51) KDM4ETOP2ATOP2BPIK3CGGSK3B
SCHEMBL7960307 0.90 KDM4E (0.55) KDM4ETOP2ATOP2BPIK3CGGSK3B
SCHEMBL7951788 0.85 KDM4E (0.60) KDM4ETOP2ATOP2BPIK3CGGSK3B
SCHEMBL7946345 0.85 KDM4E (0.63) KDM4ETOP2ATOP2BPIK3CGGSK3B
SCHEMBL7953294 0.84 KDM4E (0.65) KDM4ETOP2ATOP2BPIK3CGGSK3B
SCHEMBL7961896 0.83 HTR3A (0.43) KDM4ETOP2ATOP2BPIK3CGGSK3B
SCHEMBL7955375 0.82 KDM4E (0.50) KDM4ETOP2ATOP2BPIK3CGGSK3B
SCHEMBL7946466 0.82 KDM4E (0.47) KDM4ETOP2ATOP2BPIK3CGGSK3B
SCHEMBL7951798 0.82 KDM4E (0.47) KDM4ETOP2ATOP2BPIK3CGGSK3B

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-6331548-B1 PREVENTION OR TREATMENT OF CYTOKINE RELATED DISEASES SUNTORY LIMITED (JP) 2001-12-18 US disclosed
EP-0978516-A1 1-CYCLOALKYL-1,8-NAPHTHYRIDIN-4-ONE DERIVATIVES WITH PHOSPHODIESTERASE IV INHIBITORY ACTIVITY SUNTORY LIMITED (JP) 2000-02-09 EP disclosed