SCHEMBL2907114

SCHEMBL2907114

COc1ccc(C)cc1-c1ccc(S(=O)(=O)c2ccccc2)c(F)c1

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 10/20 0.48
PTGS1 P23219 4/20 0.48
HTR6 P50406 1/20 0.47
NR1I2 O75469 4/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
SLC2A1 P11166 1/20 0.40
ABCC9 O60706 1/20 0.39
ABCC8 Q09428 1/20 0.39
KCNJ11 Q14654 1/20 0.39
KCNJ8 Q15842 1/20 0.39
ALOX5AP P20292 1/20 0.39
FEN1 P39748 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
SCHEMBL2908208 0.90 PTGS2 (0.47) PTGS2PTGS1NR1I2MEN1KMT2A
SCHEMBL1989553 0.89 HTR6 (0.51) PTGS2PTGS1HTR6MEN1KMT2A
SCHEMBL1993598 0.84 PTGDR2 (0.61) ALOX5APFEN1
SCHEMBL3387420 0.84 FEN1 (0.41) PTGS2PTGS1HTR6ABCC9ABCC8
SCHEMBL1990646 0.82 POLB (0.44) PTGS2PTGS1HTR6MEN1KMT2A
SCHEMBL1990982 0.82 ABCC9 (0.40) PTGS2PTGS1HTR6MEN1KMT2A
SCHEMBL1989562 0.81 PTGS2 (0.45) PTGS2PTGS1HTR6MEN1KMT2A
SCHEMBL1989516 0.78 PTGS2 (0.47) PTGS2PTGS1
SCHEMBL1991595 0.77 NR3C1 (0.47) PTGS2PTGS1NR1I2
SCHEMBL4150829 0.77 LMNA (0.43) PTGS2PTGS1ALOX5APFEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8415394-B2 Biphenyloxyacetic acid derivatives for the treatment of respiratory disease ASTRAZENECA AB (GB) 2013-04-09 US disclosed
US-8349897-B2 Biphenyloxyacetic acid derivatives for the treatment of respiratory disease ASTRAZENECA AB (SE) 2013-01-08 US disclosed
US-20120178814-A1 Biphenyloxyacetic Acid Derivatives for the Treatment of Respiratory Disease LUKER TIMOTHY JON (GB) 2012-07-12 US disclosed
EP-1937633-B1 BIPHENYLOXYACETIC ACID DERIVATIVES FOR THE TREATMENT OF RESPIRATORY DISEASE ASTRAZENECA AB (SE) 2010-08-04 EP disclosed
US-20090036535-A1 Biphenyloxyacetic Acid Derivatives for the Treatment of Respiratory Disease ASTRAZENECA AB (SE) 2009-02-05 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20120178814-A1 Biphenyloxyacetic Acid Derivatives for the Treatment of Respiratory Disease BPGM, PPARA, HPD PTGS2 1220/4885PTGS1 1276/4885HTR6 211/4885
US-20090036535-A1 Biphenyloxyacetic Acid Derivatives for the Treatment of Respiratory Disease BPGM, PPARA, HPD PTGS2 1220/4885PTGS1 1276/4885HTR6 211/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.