SCHEMBL4637511

SCHEMBL4637511

CCS(=O)(=O)c1ccc(Oc2c[c]ccc2F)c(Cl)c1

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 5/20 0.40
EPAS1 Q99814 2/20 0.37
ALDH1A1 P00352 2/20 0.37
MEN1 O00255 1/20 0.37
LMNA P02545 1/20 0.37
MAPT P10636 1/20 0.37
THRB P10828 1/20 0.37
HTT P42858 1/20 0.37
KMT2A Q03164 1/20 0.37
BRD4 O60885 3/20 0.36
PTGS2 P35354 2/20 0.35
RORC P51449 1/20 0.35
SLC6A2 P23975 1/20 0.34
SLC6A3 Q01959 1/20 0.34
PTGS1 P23219 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
SOS1 Q07889 1/20 0.34

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
SCHEMBL4637479 0.88 PTGDR2 (0.41) PTGDR2EPAS1ALDH1A1MAPTTHRB
SCHEMBL4637426 0.85 PTGDR2 (0.42) PTGDR2EPAS1ALDH1A1MAPTBRD4
SCHEMBL4782137 0.84 PTGDR2 (0.40) PTGDR2EPAS1ALDH1A1LMNAHTT
SCHEMBL4637399 0.78 EPAS1 (0.47) PTGDR2EPAS1ALDH1A1BRD4SOS1
SCHEMBL4638438 0.77 PTGDR2 (0.45) PTGDR2BRD4RORC
SCHEMBL3927504 0.77 ALDH1A1 (0.42) PTGDR2EPAS1ALDH1A1BRD4SLC6A2
SCHEMBL3927507 0.76 ALDH1A1 (0.44) PTGDR2EPAS1ALDH1A1BRD4SLC6A2
SCHEMBL4876608 0.76 ALDH1A1 (0.41) PTGDR2EPAS1ALDH1A1BRD4SLC6A2
SCHEMBL4638354 0.76 EPAS1 (0.46) EPAS1RORC
SCHEMBL4639087 0.75 EPAS1 (0.44) PTGDR2EPAS1ALDH1A1SMN1; SMN2SOS1

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-1937632-A1 NOVEL COMPOUNDS Astra Zeneca AB (SE) 2008-07-02 EP claimed
WO-2007039736-A1 NOVEL COMPOUNDS ASTRAZENECA AB (SE) 2007-04-12 WO claimed
EP-1937632-A1 NOVEL COMPOUNDS Astra Zeneca AB (SE) 2008-07-02 EP disclosed
WO-2007039736-A1 NOVEL COMPOUNDS ASTRAZENECA AB (SE) 2007-04-12 WO disclosed