SCHEMBL10115727

SCHEMBL10115727

CC(C)(C)S(=O)(=O)NC1CCN(C(=O)NC2CC2)CC1

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.47
HTT P42858 1/20 0.45
MAPK1 P28482 1/20 0.43
POLB P06746 2/20 0.43
EPHX2 P34913 1/20 0.43
ALDH1A1 P00352 2/20 0.42
KDM4E B2RXH2 1/20 0.41
NPSR1 Q6W5P4 1/20 0.40
GAA P10253 1/20 0.40
HSD17B10 Q99714 1/20 0.40
EPHX1 P07099 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
SCHEMBL10115725 0.93 LMNA (0.57) LMNAHTTMAPK1POLBEPHX2
SCHEMBL24435818 0.82 EPHX2 (0.50) EPHX2ALDH1A1EPHX1
SCHEMBL2980571 0.82 ALDH1A1 (0.38) LMNAEPHX2ALDH1A1EPHX1
SCHEMBL10133512 0.81 CCR8 (0.41) LMNAEPHX2ALDH1A1KDM4EHSD17B10
SCHEMBL5540753 0.81 ALDH1A1 (0.41) LMNAEPHX2ALDH1A1NPSR1EPHX1
SCHEMBL10115742 0.80 LMNA (0.44) LMNAHTTMAPK1POLBEPHX2
SCHEMBL10115703 0.78 TSHR (0.57) LMNAMAPK1NPSR1GAA
SCHEMBL10116081 0.78 LMNA (0.47) LMNAHTTMAPK1POLBEPHX2
SCHEMBL2754308 0.78 DPP4 (0.39) LMNAEPHX2ALDH1A1KDM4EHSD17B10
SCHEMBL12048931 0.77 CA12 (0.50) LMNAALDH1A1KDM4E

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 11 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-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 LMNA 1925/4885HTT 2081/4885MAPK1 1371/4885
US-20100292500-A1 NPY Y5 ANTAGONIST NPY5R, NPY1R, NPY2R LMNA 2068/4885HTT 1904/4885MAPK1 1345/4885
US-20110039802-A1 NPY Y5 ANTAGONIST NPY5R, NPY1R, NPY2R LMNA 1857/4885HTT 2095/4885MAPK1 1323/4885

“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.