SCHEMBL1993879

SCHEMBL1993879

COc1ccc(S(=O)(=O)c2ccc(-c3cc(Cl)ccc3OC(C(=O)O)C(C)(C)C)cc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 2/20 0.44
MMP9 P14780 5/20 0.43
MMP2 P08253 4/20 0.43
MMP3 P08254 3/20 0.43
MMP8 P22894 3/20 0.43
MMP13 P45452 3/20 0.43
MMP12 P39900 3/20 0.43
MMP14 P50281 2/20 0.43
MMP16 P51512 2/20 0.43
LMNA P02545 1/20 0.41
MMP1 P03956 2/20 0.40
MMP7 P09237 1/20 0.40
NR1I2 O75469 1/20 0.40
PKM P14618 2/20 0.40
FLT1 P17948 1/20 0.39
FLT4 P35916 1/20 0.39
KDR P35968 1/20 0.39
HTT P42858 1/20 0.39
GAA P10253 1/20 0.39
BACE1 P56817 1/20 0.38

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
SCHEMBL14828506 0.80 PTGDR2 (0.43) PTGDR2HSD11B1
SCHEMBL1990463 0.78 PTGDR2 (0.71) PTGDR2
SCHEMBL1994495 0.78 PTGDR2 (0.49) PTGDR2NR1I2HSD11B1
SCHEMBL1996728 0.78 PPARG (0.42) PTGDR2
SCHEMBL1996821 0.77 PTGDR2 (0.47) PTGDR2NR1I2
SCHEMBL1371698 0.76 PTGDR2 (0.71) PTGDR2HTT
SCHEMBL2112216 0.74 CTSA (0.39) PTGDR2
SCHEMBL1991361 0.74 TSHR (0.51) PTGDR2
SCHEMBL2104084 0.74 PTGDR2 (0.36) PTGDR2LMNAHTT
SCHEMBL1988977 0.73 PTGDR2 (0.45) PTGDR2

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 3 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-8008350-B2 Biphenyloxyacetic acid derivatives for the treatment of respiratory disease ASTRAZENECA AB (SE) 2011-08-30 US disclosed
US-20110152374-A1 Biphenyloxyacetic Acid Derivatives for the Treatment of Respiratory Disease ASTRAZENECA AB (SE) 2011-06-23 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 (1 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-20110152374-A1 Biphenyloxyacetic Acid Derivatives for the Treatment of Respiratory Disease BPGM, PPARA, HPD PTGDR2 568/4885MMP9 3597/4885MMP2 1639/4885

“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.