SCHEMBL7300742

SCHEMBL7300742

COc1ccc(C(O)Cc2ccncc2)c2c1OC1(C=C2)CCCC1

nearest known ligand 0.40

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 1/20 0.40
PDE4A P27815 16/20 0.37
PDE4B Q07343 2/20 0.35
PDE4D Q08499 2/20 0.35
PDE4C Q08493 1/20 0.35
ITGA4 P13612 1/20 0.33
ITGB7 P26010 1/20 0.33

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
SCHEMBL5723126 0.77 PDE4A (0.39) PDE4APDE4BPDE4DPDE4C
SCHEMBL5722950 0.77 PDE4A (0.39) PDE4APDE4BPDE4DPDE4C
SCHEMBL8326536 0.74 MAPT (0.45) PDE4B
SCHEMBL7300353 0.74 MAPT (0.45) PDE4B
SCHEMBL5722871 0.73 PDE4B (0.40) HIF1APDE4APDE4BPDE4DPDE4C
SCHEMBL5722773 0.72 PDE4B (0.36) HIF1APDE4APDE4BPDE4DPDE4C
SCHEMBL7303717 0.71 SMN1; SMN2 (0.35) HIF1A
SCHEMBL5722826 0.70 KDM4E (0.44) HIF1APDE4D
SCHEMBL5723023 0.69 KDM4E (0.43) HIF1APDE4D
SCHEMBL5722916 0.69 PDE4B (0.38) PDE4APDE4BPDE4DPDE4C

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-0819689-A1 5-substituted (2H) chromenes Byk Gulden Lomberg Chemische Fabrik GmbH (DE) 1998-01-21 EP disclosed