SCHEMBL21965200

SCHEMBL21965200

CCOc1ccc(-n2nc(C(N)=O)c3c2C(=O)N(c2cccc(C)c2)CC3)cc1

nearest known ligand 0.58

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 1/20 0.58
PDE4B Q07343 1/20 0.58
PDE4C Q08493 1/20 0.58
PDE4D Q08499 1/20 0.58
F10 P00742 19/20 0.56
F2 P00734 3/20 0.56
SLC29A1 Q99808 1/20 0.56

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
SCHEMBL21504326 0.90 F10 (0.69) F10F2SLC29A1
SCHEMBL21965676 0.90 F10 (0.64) F10F2SLC29A1
SCHEMBL21504047 0.85 F10 (0.62) F10F2SLC29A1
SCHEMBL17572202 0.83 F10 (0.62) F10F2SLC29A1
SCHEMBL17572149 0.83 F10 (0.51) F10F2SLC29A1
SCHEMBL17572256 0.83 F10 (0.50) F10F2SLC29A1
SCHEMBL28412605 0.83 F10 (0.81) F10F2SLC29A1
SCHEMBL17572293 0.82 F10 (0.56) F10F2SLC29A1
SCHEMBL17572320 0.82 F10 (0.66) F10F2SLC29A1
SCHEMBL21504328 0.82 PDE4A (0.60) PDE4APDE4BPDE4CPDE4DF10

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
EP-3190111-B1 PYRAZOLO[3,4-C]PYRIDINE DERIVATIVES CSPC ZHONGQI PHARMACEUTICAL TECH SHIJIAZHUANG CO LTD (CN) 2020-05-06 EP disclosed