SCHEMBL7953574

SCHEMBL7953574

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

nearest known ligand 0.52

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ELANE P08246 5/20 0.52
HTR3A P46098 6/20 0.43
TYK2 P29597 4/20 0.42
TNF P01375 1/20 0.42
PDE4B Q07343 2/20 0.40

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
SCHEMBL7957249 1.00 ELANE (0.52) ELANEHTR3ATYK2TNFPDE4B
SCHEMBL7953666 0.89 ELANE (0.58) ELANEHTR3A
SCHEMBL7966469 0.87 ELANE (0.56) ELANEHTR3A
SCHEMBL7954868 0.87 ELANE (0.56) ELANEHTR3A
SCHEMBL7946372 0.86 ELANE (0.55) ELANEHTR3A
SCHEMBL7960265 0.85 ELANE (0.54) ELANEHTR3A
SCHEMBL7966421 0.85 ELANE (0.54) ELANEHTR3A
SCHEMBL7954825 0.84 KDM4E (0.46) HTR3ATYK2
SCHEMBL7946367 0.84 KDM4E (0.46) HTR3ATYK2
SCHEMBL7966257 0.84 ELANE (0.53) ELANEHTR3A

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