SCHEMBL10115044

SCHEMBL10115044

CC(CNC(=O)Nc1ccc(N2CC(C)O[C@@H](C)C2)cc1)CNS(=O)(=O)C(C)(C)C

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.46
NAMPT P43490 2/20 0.39
CYP2C9 P11712 2/20 0.39
TRPV1 Q8NER1 1/20 0.38
CCR3 P51677 1/20 0.35
PIK3R1 P27986 1/20 0.35
MTOR P42345 1/20 0.35
KMT2A Q03164 1/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2C19 P33261 1/20 0.35
ALDH1A1 P00352 3/20 0.34
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34

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
SCHEMBL13204501 1.00 MAPT (0.46) MAPTNAMPTCYP2C9TRPV1CCR3
SCHEMBL10133227 1.00 MAPT (0.46) MAPTNAMPTCYP2C9TRPV1CCR3
SCHEMBL10133522 0.88 MAPT (0.48) MAPTNAMPTCYP2C9TRPV1CCR3
SCHEMBL13204580 0.88 MAPT (0.48) MAPTNAMPTCYP2C9TRPV1CCR3
SCHEMBL10115406 0.88 MAPT (0.48) MAPTNAMPTCYP2C9TRPV1CCR3
SCHEMBL12882896 0.87 TRPV1 (0.38) MAPTCYP2C9TRPV1KMT2ACYP3A4
SCHEMBL10133428 0.84 MAPT (0.48) MAPTNAMPTCYP2C9TRPV1ALDH1A1
SCHEMBL10114424 0.84 MAPT (0.48) MAPTNAMPTCYP2C9TRPV1ALDH1A1
SCHEMBL13972710 0.77 MAPT (0.49) MAPTALDH1A1
SCHEMBL13204340 0.76 MAPT (0.48) MAPTNAMPTCYP2C9TRPV1ALDH1A1

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-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

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-20100292500-A1 NPY Y5 ANTAGONIST NPY5R, NPY1R, NPY2R MAPT 3367/4885NAMPT 2350/4885CYP2C9 1654/4885

“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.