SCHEMBL6814857

SCHEMBL6814857

O=C(Cl)c1ccc(OC(F)F)c(OC(F)F)c1

nearest known ligand 0.54

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PDE4D Q08499 14/20 0.54
PDE4A P27815 13/20 0.54
PDE4B Q07343 12/20 0.54
PDE4C Q08493 12/20 0.54
KDM4E B2RXH2 1/20 0.46
HTT P42858 1/20 0.46
NPC1 O15118 1/20 0.40
TP53 P04637 1/20 0.40
TSHR P16473 1/20 0.40
MAPK1 P28482 1/20 0.40
RAB9A P51151 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
ABCB11 O95342 1/20 0.40

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
SCHEMBL4696721 0.90 KDM4E (0.58) PDE4DPDE4APDE4BPDE4CKDM4E
SCHEMBL1013113 0.86 MAPT (0.50) PDE4DPDE4APDE4BPDE4CKDM4E
SCHEMBL6822446 0.83 PDE4D (0.67) PDE4DPDE4APDE4BPDE4C
SCHEMBL1030765 0.83 PDE4D (0.60) PDE4DPDE4APDE4BPDE4C
SCHEMBL1029279 0.83 PDE4A (0.59) PDE4DPDE4APDE4BPDE4CKDM4E
SCHEMBL29440119 0.81 PDE4A (0.54) PDE4DPDE4APDE4BPDE4CKDM4E
SCHEMBL142851 0.81 PDE4D (0.54) PDE4DPDE4APDE4BPDE4CKDM4E
SCHEMBL184260 0.81 PDE4B (0.70) PDE4DPDE4APDE4BPDE4CABCB11
SCHEMBL31614784 0.80 PDE4A (0.52) PDE4DPDE4APDE4BPDE4CKDM4E
SCHEMBL8890021 0.79 PDE4B (0.62) PDE4DPDE4APDE4BPDE4C

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-2004022536-A1 NEW HETEROCYCLIC AMIDE COMPOUNDS USEFUL FOR THE TREATMENT OF INFLAMMATORY AND ALLERGIC DISORDERS: PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM GLENMARK PHARMACEUTICALS LIMITED (US) 2004-03-18 WO disclosed