SCHEMBL7946367

SCHEMBL7946367

O=C(O)c1cn([C@@H]2CCOC2)c2ncccc2c1=O

nearest known ligand 0.46

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.46
TYK2 P29597 9/20 0.43
HTR3A P46098 4/20 0.41
KDM4C Q9H3R0 1/20 0.41
TOP2A P11388 1/20 0.40
TOP2B Q02880 1/20 0.40
PIK3CG P48736 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
SCHEMBL7954825 1.00 KDM4E (0.46) KDM4ETYK2HTR3AKDM4CTOP2A
SCHEMBL7960307 0.87 KDM4E (0.55) KDM4EKDM4CTOP2ATOP2BPIK3CG
SCHEMBL7946345 0.84 KDM4E (0.63) KDM4ETOP2ATOP2BPIK3CG
SCHEMBL7951788 0.84 KDM4E (0.60) KDM4EHTR3ATOP2ATOP2BPIK3CG
SCHEMBL7953574 0.84 ELANE (0.52) TYK2HTR3A
SCHEMBL7957249 0.84 ELANE (0.52) TYK2HTR3A
SCHEMBL7960474 0.84 CNR1 (0.50) TYK2
SCHEMBL7962950 0.84 CNR1 (0.50) TYK2
SCHEMBL7953294 0.83 KDM4E (0.65) KDM4ETOP2ATOP2BPIK3CG
SCHEMBL7963122 0.82 KDM4E (0.51) KDM4EKDM4CTOP2ATOP2BPIK3CG

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
US-6331548-B1 PREVENTION OR TREATMENT OF CYTOKINE RELATED DISEASES SUNTORY LIMITED (JP) 2001-12-18 US disclosed