SCHEMBL10116353

SCHEMBL10116353

Cc1cc(C(F)(F)F)ccc1CNC(=O)c1ccc(NS(=O)(=O)C(C)(C)C)cc1

nearest known ligand 0.58

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 17/20 0.58
NR1H4 Q96RI1 13/20 0.57
PPARG P37231 1/20 0.50
LMNA P02545 1/20 0.48
KMT2A Q03164 1/20 0.48
NPSR1 Q6W5P4 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
MAPT P10636 1/20 0.47
DDR1 Q08345 1/20 0.46

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
SCHEMBL12882064 0.85 EPHX2 (0.62) EPHX2NR1H4PPARGLMNAKMT2A
SCHEMBL10114512 0.83 EPHX2 (0.64) EPHX2NR1H4PPARGLMNAKMT2A
SCHEMBL13105801 0.81 RORC (0.42) EPHX2PPARG
SCHEMBL10116297 0.80 ALDH1A1 (0.57) NR1H4LMNAKMT2AL3MBTL1MAPT
SCHEMBL14424307 0.79 EPHX2 (0.53) EPHX2NR1H4PPARGLMNAKMT2A
SCHEMBL10114489 0.76 TRPV1 (0.68) KMT2ANPSR1MAPT
SCHEMBL10116339 0.75 MAPT (0.61) LMNAKMT2AMAPT
SCHEMBL29008908 0.74 EPHX2 (0.55) EPHX2NR1H4PPARG
SCHEMBL29990194 0.74 EPHX2 (0.55) EPHX2NR1H4PPARG
SCHEMBL14453580 0.73 EPHX2 (0.49) EPHX2NR1H4PPARGLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8115027-B2 NPY Y5 antagonist SHIONOGI & CO., LTD. (JP) 2012-02-14 US disclosed
US-8115027-B2 NPY Y5 antagonist SHIONOGI & CO., LTD. (JP) 2012-02-14 US disclosed
US-20110039802-A1 NPY Y5 ANTAGONIST KAWANISHI YASUYUKI 2011-02-17 US disclosed
US-20100292500-A1 NPY Y5 ANTAGONIST KAWANISHI YASUYUKI 2010-11-18 US disclosed
US-20100292500-A1 NPY Y5 ANTAGONIST KAWANISHI YASUYUKI 2010-11-18 US disclosed
US-7781461-B2 NPY Y5 antagonist KAWANISHI YASUYUKI 2010-08-24 US disclosed
US-7781461-B2 NPY Y5 antagonist KAWANISHI YASUYUKI 2010-08-24 US disclosed
US-7265130-B2 NPY Y5 antagonist SHIONOGI & CO., LTD. (JP) 2007-09-04 US disclosed
US-20070015762-A1 NPY Y5 antagonist KAWANISHI YASUYUKI 2007-01-18 US disclosed
US-20070015762-A1 NPY Y5 antagonist KAWANISHI YASUYUKI 2007-01-18 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 (3 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-20070015762-A1 NPY Y5 antagonist NPY5R, NPY1R, NPY2R EPHX2 2158/4885NR1H4 283/4885PPARG 1085/4885
US-20100292500-A1 NPY Y5 ANTAGONIST NPY5R, NPY1R, NPY2R EPHX2 2527/4885NR1H4 311/4885PPARG 1161/4885
US-20110039802-A1 NPY Y5 ANTAGONIST NPY5R, NPY1R, NPY2R EPHX2 2306/4885NR1H4 278/4885PPARG 1068/4885

“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.