SCHEMBL10113367

SCHEMBL10113367

CC(C)(C)S(=O)(=O)NC1CCC(C(=O)NCCc2ccc(S(N)(=O)=O)cc2)CC1

nearest known ligand 0.74

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.59
KMT2A Q03164 5/20 0.56
MEN1 O00255 4/20 0.56
KDM4E B2RXH2 1/20 0.54
PKM P14618 1/20 0.54
ATM Q13315 1/20 0.53
TAAR1 Q96RJ0 1/20 0.52
CA1 P00915 2/20 0.51
CA2 P00918 2/20 0.51
TP53 P04637 1/20 0.51

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
SCHEMBL13203870 1.00 ALDH1A1 (0.59) ALDH1A1KMT2AMEN1KDM4EPKM
SCHEMBL10114150 0.86 CYP2C19 (0.60) ALDH1A1KMT2AMEN1KDM4E
SCHEMBL14424266 0.86 KMT2A (0.58) ALDH1A1KMT2AMEN1KDM4EPKM
SCHEMBL10114135 0.86 KMT2A (0.58) ALDH1A1KMT2AMEN1KDM4EPKM
SCHEMBL10114156 0.84 ALDH1A1 (0.47) ALDH1A1KMT2AMEN1
SCHEMBL10114151 0.84 NPY5R (0.61) ALDH1A1KMT2AMEN1TP53
SCHEMBL17089971 0.83 KDM4E (0.55) ALDH1A1KDM4EPKMATMTAAR1
SCHEMBL10115646 0.83 ATM (0.51) ALDH1A1KMT2AKDM4EPKMATM
SCHEMBL10133353 0.80 KMT2A (0.65) ALDH1A1KMT2AMEN1KDM4E
SCHEMBL13203776 0.80 KMT2A (0.65) ALDH1A1KMT2AMEN1KDM4E

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 5 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-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
EP-2014285-A1 NPYY5 antagonists Shionogi&Co., Ltd. (JP) 2009-01-14 EP disclosed
US-7265130-B2 NPY Y5 antagonist SHIONOGI & CO., LTD. (JP) 2007-09-04 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-20100292500-A1 NPY Y5 ANTAGONIST NPY5R, NPY1R, NPY2R ALDH1A1 4599/4885KMT2A 2768/4885MEN1 2932/4885
US-20110039802-A1 NPY Y5 ANTAGONIST NPY5R, NPY1R, NPY2R ALDH1A1 4517/4885KMT2A 2953/4885MEN1 2926/4885

“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.