SCHEMBL8799715

SCHEMBL8799715

[CH2]COC(Cc1ccncc1)c1nc(C(C)C)c(Sc2cccc(Cl)c2)[nH]1

nearest known ligand 0.34

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PDE4D Q08499 1/20 0.32
PDE4B Q07343 1/20 0.32
POLB P06746 1/20 0.31
TYMS P04818 1/20 0.30
TOP2A P11388 1/20 0.30

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
SCHEMBL7084598 0.90 ADRB2 (0.33) PDE4DPDE4B
SCHEMBL7081545 0.87 CSNK2A2 (0.34) PDE4DPDE4BPOLBTYMS
SCHEMBL6973004 0.86 SLC6A9 (0.32)
SCHEMBL7079911 0.85 SLC2A1 (0.34) PDE4DPDE4BPOLBTYMS
SCHEMBL6970653 0.81
SCHEMBL6972366 0.81 ALDH1A1 (0.37)
SCHEMBL7084286 0.79 MAPK13 (0.30)
SCHEMBL597335 0.78 MEN1 (0.31)
SCHEMBL7080940 0.78 MEN1 (0.31)
SCHEMBL6967066 0.78 CYP3A4 (0.32)

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-0786455-A1 IMIDAZOLE DERIVATIVE SHIONOGI & CO., LTD. (JP) 1997-07-30 EP disclosed