SCHEMBL6471016

SCHEMBL6471016

O=C(Nc1c(Cl)cncc1Cl)c1cccc2c1c1cc(Cl)ccc1n2OCCc1ccc(F)cc1

nearest known ligand 0.42

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 17/20 0.42
PDE4A P27815 12/20 0.42
PDE4C Q08493 12/20 0.42
PDE4D Q08499 12/20 0.42
P2RX7 Q99572 1/20 0.39
CCR1 P32246 1/20 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
SCHEMBL6473039 0.91 PDE4B (0.44) PDE4BPDE4APDE4CPDE4DP2RX7
SCHEMBL6472455 0.90 PDE4B (0.46) PDE4BPDE4APDE4CPDE4DP2RX7
SCHEMBL6471528 0.89 PDE4A (0.34) PDE4BPDE4APDE4CPDE4DP2RX7
SCHEMBL6471457 0.87 JAK2 (0.41)
SCHEMBL6471041 0.87 CYP11B2 (0.48) PDE4BPDE4APDE4CPDE4D
SCHEMBL6470724 0.86 PDE4B (0.41) PDE4BPDE4APDE4CPDE4DP2RX7
SCHEMBL6472450 0.84 PDE4B (0.44) PDE4BPDE4APDE4CPDE4DP2RX7
SCHEMBL6471502 0.82 PDE4B (0.46) PDE4BPDE4APDE4CPDE4DP2RX7
SCHEMBL6472098 0.81 PDE4B (0.45) PDE4BPDE4APDE4CPDE4D
SCHEMBL6470748 0.79 PDE4B (0.46) PDE4BPDE4APDE4CPDE4DP2RX7

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1554262-A1 NOVEL TRICYCLIC COMPOUNDS USEFUL FOR THE TREATMENT OF INFLAMMATORY AND ALLERGIC DISORDERS: PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM Glenmark Pharmaceuticals Limited (IN) 2005-07-20 EP claimed
WO-2004037805-A1 NOVEL TRICYCLIC COMPOUNDS USEFUL FOR THE TREATMENT OF INFLAMMATORY AND ALLERGIC DISORDERS: PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM GLENMARK PHARMACEUTICALS LTD. (US) 2004-05-06 WO claimed
EP-1554262-A1 NOVEL TRICYCLIC COMPOUNDS USEFUL FOR THE TREATMENT OF INFLAMMATORY AND ALLERGIC DISORDERS: PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM Glenmark Pharmaceuticals Limited (IN) 2005-07-20 EP disclosed
WO-2004037805-A1 NOVEL TRICYCLIC COMPOUNDS USEFUL FOR THE TREATMENT OF INFLAMMATORY AND ALLERGIC DISORDERS: PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM GLENMARK PHARMACEUTICALS LTD. (US) 2004-05-06 WO disclosed