SCHEMBL4835933

SCHEMBL4835933

O=S(=O)(Cc1ccccc1F)c1ccc(Oc2cc(Cc3nnn[nH]3)cc(C(F)(F)CF)c2)c(Cl)c1

nearest known ligand 0.33

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
EPAS1 Q99814 1/20 0.33

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
SCHEMBL1649790 0.93 EPAS1 (0.35) EPAS1
SCHEMBL4835936 0.90 EPAS1 (0.35) EPAS1
SCHEMBL1651357 0.83 KMT2A (0.35) EPAS1
SCHEMBL1649788 0.81 EPAS1 (0.38) EPAS1
SCHEMBL1653517 0.81 EPAS1 (0.36) EPAS1
SCHEMBL1651017 0.80 GAA (0.36) EPAS1
SCHEMBL1651101 0.77 PTGDR2 (0.39) EPAS1
SCHEMBL1651526 0.77 EPAS1 (0.37) EPAS1
SCHEMBL585881 0.76 EPAS1 (0.42) EPAS1
SCHEMBL1653612 0.75 EPAS1 (0.36) EPAS1

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-1963259-A2 SUBSTITUTED DIPHENYLETHERS, -AMINES, -SULFIDES AND -METHANES FOR THE TREATMENT OF RESPIRATORY DISEASE AstraZeneca AB (SE) 2008-09-03 EP claimed
WO-2007068894-A2 SUBSTITUTED DIPHENYLETHERS, -AMINES, -SULFIDES AND -METHANES FOR THE TREATMENT OF RESPIRATORY DISEASE ASTRAZENECA AB (SE) 2007-06-21 WO claimed