SCHEMBL4974075

SCHEMBL4974075

CCC(=O)N1CCC(Oc2cc(C3=NOC4(CCOC4)C3)ccc2OC(F)F)C1

nearest known ligand 0.41

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 13/20 0.41
PIK3CA P42336 9/20 0.41
PIK3CG P48736 5/20 0.41
PIK3CB P42338 5/20 0.41
PDE4D Q08499 7/20 0.39
PDE4A P27815 4/20 0.39
PDE4B Q07343 4/20 0.39
PDE4C Q08493 4/20 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
SCHEMBL917203 1.00 PIK3CD (0.41) PIK3CDPIK3CAPIK3CGPIK3CBPDE4D
SCHEMBL917405 0.95 PDE4D (0.43) PIK3CDPIK3CAPIK3CGPIK3CBPDE4D
SCHEMBL918339 0.95 PDE4D (0.41) PIK3CDPIK3CAPIK3CGPIK3CBPDE4D
SCHEMBL916681 0.91 PIK3CD (0.39) PIK3CDPIK3CAPIK3CGPIK3CBPDE4D
SCHEMBL918060 0.91 PIK3CD (0.40) PIK3CDPIK3CAPIK3CBPDE4DPDE4A
SCHEMBL3676661 0.91 PDE4D (0.37) PDE4DPDE4APDE4BPDE4C
SCHEMBL3680467 0.91 PDE4D (0.37) PDE4DPDE4APDE4BPDE4C
SCHEMBL917973 0.88 PDE4D (0.41) PDE4DPDE4APDE4BPDE4C
SCHEMBL916207 0.88 PDE4D (0.48) PIK3CDPIK3CAPIK3CGPIK3CBPDE4D
SCHEMBL917070 0.88 PDE4D (0.48) PIK3CDPIK3CAPIK3CGPIK3CBPDE4D

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
WO-2008035315-A9 INHIBITORS OF PHOSPHODIESTERASE TYPE-IV RANBAXY LAB LTD (IN) 2008-10-23 WO disclosed