SCHEMBL14364571

SCHEMBL14364571

O=C(Nc1c(Cl)cncc1Cl)c1ccc(CC2CCCC2)c2oc3ccccc3c12

nearest known ligand 0.45

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 17/20 0.45
PDE4D Q08499 15/20 0.42
PDE4A P27815 14/20 0.40
PDE4C Q08493 14/20 0.40
P2RX7 Q99572 2/20 0.38

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
SCHEMBL14364381 0.87 PDE4B (0.35) PDE4BPDE4D
SCHEMBL8353640 0.83 LMNA (0.46)
SCHEMBL5022733 0.82 PDE4B (0.52) PDE4BPDE4DPDE4APDE4C
SCHEMBL5023418 0.81 PDE4B (0.51) PDE4BPDE4DPDE4APDE4C
SCHEMBL14184593 0.80 PDE4B (0.47) PDE4BPDE4DPDE4APDE4C
SCHEMBL5023357 0.78 PDE4B (0.51) PDE4BPDE4DPDE4APDE4C
SCHEMBL5022238 0.77 PDE4B (0.69) PDE4BPDE4DPDE4APDE4C
SCHEMBL5022869 0.77 PDE4B (0.56) PDE4BPDE4DPDE4APDE4C
SCHEMBL8353862 0.76 PDE4B (0.54) PDE4BPDE4DPDE4APDE4C
SCHEMBL5025155 0.76 PDE4B (0.53) PDE4BPDE4DPDE4APDE4CP2RX7

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-1554262-B1 NOVEL TRICYCLIC COMPOUNDS USEFUL FOR THE TREATMENT OF INFLAMMATORY AND ALLERGIC DISORDERS: PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM GLENMARK PHARMACEUTICALS LTD (IN) 2007-12-05 EP disclosed