SCHEMBL15840366

SCHEMBL15840366

CC(C)(C)OCc1ccc(S(C)(=O)=O)cc1

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 2/20 0.47
ENPP2 Q13822 1/20 0.47
EPHX2 P34913 1/20 0.42
NR1H4 Q96RI1 1/20 0.42
GPR119 Q8TDV5 9/20 0.41
RORC P51449 1/20 0.41
CA12 O43570 1/20 0.40
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
CA9 Q16790 1/20 0.40
CYP4F2 P78329 1/20 0.39
CYP4A11 Q02928 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
SCHEMBL15800267 0.85 PTGS2 (0.45) PTGS2ENPP2EPHX2NR1H4RORC
SCHEMBL23343670 0.83 CA2 (0.61) CA12CA1CA2CA9
SCHEMBL10202790 0.82 PTGS2 (0.43) PTGS2ENPP2EPHX2NR1H4GPR119
SCHEMBL648537 0.81 AGXT (0.39)
SCHEMBL15677618 0.79 PTGS2 (0.43) PTGS2ENPP2RORCCA12CA1
SCHEMBL5522736 0.78 PTGS2 (0.70) PTGS2ENPP2CA12CA1CA2
SCHEMBL24507590 0.77 ENPP2 (0.52) PTGS2ENPP2CA12CA1CA2
SCHEMBL3850384 0.76 PTGS2 (0.50) PTGS2ENPP2CA12CA1CA2
SCHEMBL6480783 0.76 CA12 (0.68) PTGS2ENPP2CA12CA1CA2
SCHEMBL26398329 0.75 PTGS2 (0.43) PTGS2ENPP2EPHX2NR1H4GPR119

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9119822-B2 Use of PDE7 inhibitors for the treatment of movement disorders OMEROS CORPORATION (US) 2015-09-01 US disclosed
US-20140179717-A1 Use of PDE7 Inhibitors for the Treatment of Movement Disorders OMEROS CORPORATION (US) 2014-06-26 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-20140179717-A1 Use of PDE7 Inhibitors for the Treatment of Movement Disorders PARK7, PDE7B, PDE7A PTGS2 2105/4885ENPP2 208/4885EPHX2 1946/4885

“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.