SCHEMBL2909345

SCHEMBL2909345

COc1ccc(S(=O)(=O)c2ccc(Br)cc2F)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PKM P14618 2/20 0.53
HSD11B1 P28845 2/20 0.48
BMP1 P13497 1/20 0.47
GAA P10253 1/20 0.46
AKR1B1 P15121 1/20 0.46
RAPGEF4 Q8WZA2 1/20 0.45
CNR2 P34972 7/20 0.45
MMP2 P08253 1/20 0.45
MMP9 P14780 1/20 0.45
MMP8 P22894 1/20 0.45
MMP12 P39900 1/20 0.45
MMP13 P45452 1/20 0.45
MMP14 P50281 1/20 0.45
MMP16 P51512 1/20 0.45
IDO1 P14902 1/20 0.44
CNR1 P21554 3/20 0.44
DRD4 P21917 1/20 0.44
DRD3 P35462 1/20 0.44
HTR6 P50406 1/20 0.44
RXFP1 Q9HBX9 1/20 0.44

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
SCHEMBL1990245 0.82 LMNA (0.55) PKMHSD11B1AKR1B1LMNA
SCHEMBL2350373 0.79 AKR1B1 (0.51) PKMHSD11B1GAAAKR1B1HTR6
SCHEMBL1991895 0.78 PKM (0.79) PKMHSD11B1GAARAPGEF4MMP2
SCHEMBL7533628 0.78 PKM (0.51) PKMHSD11B1GAARAPGEF4CNR2
SCHEMBL5631983 0.76 PKM (0.63) PKMGAARAPGEF4IDO1RXFP1
SCHEMBL25873556 0.76 MEN1 (0.46) PKMHSD11B1GAAAKR1B1RAPGEF4
SCHEMBL31149207 0.75 L3MBTL1 (0.52) BMP1
SCHEMBL4183685 0.75 L3MBTL1 (0.52) BMP1
SCHEMBL7536306 0.75 PKM (0.56) PKMHSD11B1GAARAPGEF4CNR2
SCHEMBL15352707 0.74 NMT1 (0.46) HSD11B1GAAAKR1B1SMN1; SMN2

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 PKM 1408/4885HSD11B1 1023/4885BMP1 3275/4885
US-20090036535-A1 Biphenyloxyacetic Acid Derivatives for the Treatment of Respiratory Disease BPGM, PPARA, HPD PKM 1408/4885HSD11B1 1023/4885BMP1 3275/4885

“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.