SCHEMBL10115950

SCHEMBL10115950

CC(C)S(=O)(=O)NC1CCN(C(=O)Nc2ccc(NS(=O)(=O)c3ccccc3)cc2)CC1

nearest known ligand 0.52

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.52
LMNA P02545 2/20 0.50
TP53 P04637 1/20 0.50
MAPT P10636 1/20 0.50
GAA P10253 1/20 0.47
NOD2 Q9HC29 1/20 0.46
CCR8 P51685 1/20 0.46
MEN1 O00255 2/20 0.45
ALDH1A1 P00352 2/20 0.45
F13A1 P00488 1/20 0.45
TGM2 P21980 1/20 0.45
TGM1 P22735 1/20 0.45

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
SCHEMBL10115849 0.89 ALDH1A1 (0.55) KMT2ALMNATP53CCR8ALDH1A1
SCHEMBL10116010 0.87 ALDH1A1 (0.48) KMT2ALMNAGAACCR8ALDH1A1
SCHEMBL10115945 0.85 LMNA (0.46) KMT2ALMNATP53MAPTMEN1
SCHEMBL10115628 0.85 KMT2A (0.52) KMT2ALMNATP53MAPTGAA
SCHEMBL10116117 0.85 POLB (0.54) KMT2ALMNATP53MAPTGAA
SCHEMBL10115925 0.85 NPY5R (0.48) KMT2AGAACCR8ALDH1A1
SCHEMBL10116105 0.84 KMT2A (0.56) KMT2ALMNATP53MAPTGAA
SCHEMBL13222448 0.83 GAA (0.50) KMT2ALMNAGAAMEN1ALDH1A1
SCHEMBL12882838 0.83 TSHR (0.48) KMT2ALMNAMEN1ALDH1A1
SCHEMBL10115847 0.83 LMNA (0.59) KMT2ALMNATP53MAPTGAA

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 7 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-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-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 (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-20070015762-A1 NPY Y5 antagonist NPY5R, NPY1R, NPY2R KMT2A 2912/4885LMNA 1925/4885TP53 4449/4885
US-20100292500-A1 NPY Y5 ANTAGONIST NPY5R, NPY1R, NPY2R KMT2A 2768/4885LMNA 2068/4885TP53 4417/4885

“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.