SCHEMBL5048060

SCHEMBL5048060

O=C(c1ccccc1)[C@]1(Oc2cc(C3=NOC4(CCOC4)C3)ccc2OC(F)F)CCNC1

nearest known ligand 0.32

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SSTR5 P35346 1/20 0.32
PDE4A P27815 2/20 0.31
PDE4B Q07343 2/20 0.31
PDE4C Q08493 2/20 0.31
PDE4D Q08499 2/20 0.31
WNT3A P56704 1/20 0.31
F2 P00734 1/20 0.30
F10 P00742 1/20 0.30
PRSS1 P07477 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
SCHEMBL4974070 0.87 PDE4A (0.32) SSTR5PDE4APDE4BPDE4CPDE4D
SCHEMBL916534 0.83 WNT3A (0.35) SSTR5PDE4APDE4BPDE4CPDE4D
SCHEMBL3547325 0.80 GRM2 (0.32) SSTR5PDE4APDE4BPDE4CPDE4D
SCHEMBL915571 0.78 SSTR5 (0.33) SSTR5
SCHEMBL3674756 0.78 SSTR5 (0.35) SSTR5PDE4APDE4BPDE4CPDE4D
SCHEMBL3945473 0.78 PDE4D (0.35) SSTR5PDE4APDE4BPDE4CPDE4D
SCHEMBL918227 0.77 MEN1 (0.39) PDE4APDE4BPDE4CPDE4D
SCHEMBL916709 0.76 PDE4D (0.34) SSTR5PDE4APDE4BPDE4CPDE4D
SCHEMBL3552800 0.76 GRM2 (0.40) PDE4APDE4BPDE4CPDE4D
SCHEMBL916594 0.76 PDE4D (0.37) PDE4APDE4BPDE4CPDE4D

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
EP-1948167-A1 COMPOSITIONS OF PHOSPHODIESTERASE TYPE IV INHIBITORS RANBAXY LABORATORIES, LTD. (IN) 2008-07-30 EP disclosed
WO-2007045980-A1 COMPOSITIONS OF PHOSPHODIESTERASE TYPE IV INHIBITORS RANBAXY LABORATORIES LIMITED (IN) 2007-04-26 WO disclosed