SCHEMBL2908481

SCHEMBL2908481

O=S(=O)(c1ccccc1)c1c(F)cc(-c2cc(Cl)ccc2O)cc1F

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSP90AA1 P07900 2/20 0.45
HSP90AB1 P08238 2/20 0.45
ERBB2 P04626 1/20 0.45
ACLY P53396 2/20 0.43
CA1 P00915 2/20 0.41
CA2 P00918 2/20 0.41
CA12 O43570 1/20 0.41
CA7 P43166 1/20 0.41
CA13 Q8N1Q1 1/20 0.41
POLB P06746 2/20 0.40
GAA P10253 1/20 0.40
GFER P55789 1/20 0.40
MEN1 O00255 1/20 0.39
LMNA P02545 1/20 0.39
MAPT P10636 1/20 0.39
HPGD P15428 1/20 0.39
ALOX15 P16050 1/20 0.39
MAPK1 P28482 1/20 0.39
KMT2A Q03164 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39

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
SCHEMBL2908480 0.85 PGR (0.39) HSP90AA1HSP90AB1ERBB2ACLYCA1
SCHEMBL1994313 0.81 PTGS2 (0.49) HSP90AA1HSP90AB1ERBB2ACLYCA1
SCHEMBL1992257 0.81 PTGES2 (0.47) MEN1LMNAMAPTHPGDKMT2A
SCHEMBL2902261 0.79 PTGDR2 (0.41) POLBMEN1LMNAMAPTHPGD
SCHEMBL14544600 0.79 FFAR1 (0.46) LMNAPTGDR2
SCHEMBL1991221 0.78 PTGDR2 (0.64) PTGDR2
SCHEMBL1990235 0.78 PTGDR2 (0.45) HSP90AA1HSP90AB1ERBB2ACLYPOLB
SCHEMBL1993027 0.74 MEN1 (0.51) POLBGAAMEN1MAPK1KMT2A
SCHEMBL1996728 0.74 PPARG (0.42) KMT2ANPSR1PTGDR2
SCHEMBL1993521 0.74 POLB (0.46) POLBGAAMEN1KMT2APTGDR2

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-1937633-B1 BIPHENYLOXYACETIC ACID DERIVATIVES FOR THE TREATMENT OF RESPIRATORY DISEASE ASTRAZENECA AB (SE) 2010-08-04 EP claimed