SCHEMBL10114534

SCHEMBL10114534

CC(C)(C)S(=O)(=O)NC1CCC(C(=O)Nc2ccc(F)c(C(F)(F)F)c2)CC1

nearest known ligand 0.57

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
NPY5R Q15761 1/20 0.57
KMT2A Q03164 1/20 0.49
KDR P35968 16/20 0.48
BRAF P15056 7/20 0.48
AR P10275 1/20 0.46
EPHX2 P34913 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
SCHEMBL14424174 1.00 NPY5R (0.57) NPY5RKMT2AKDRBRAFAR
SCHEMBL14424168 0.89 NPY5R (0.55) NPY5RKMT2A
SCHEMBL10114502 0.89 NPY5R (0.55) NPY5RKMT2A
SCHEMBL14424123 0.86 KMT2A (0.48) NPY5RKMT2AKDRBRAFAR
SCHEMBL10114896 0.86 KMT2A (0.48) NPY5RKMT2AKDRBRAFAR
SCHEMBL10114536 0.84 NPY5R (0.53) NPY5RKMT2AEPHX2
SCHEMBL14424172 0.84 NPY5R (0.53) NPY5RKMT2AEPHX2
SCHEMBL10115745 0.83 SLC6A3 (0.47) KMT2AAREPHX2
SCHEMBL10113370 0.83 NPY5R (0.72) NPY5RKMT2AEPHX2
SCHEMBL13203872 0.83 NPY5R (0.72) NPY5RKMT2AEPHX2

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 9 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

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 NPY5R 1/4885KMT2A 2912/4885KDR 1480/4885
US-20100292500-A1 NPY Y5 ANTAGONIST NPY5R, NPY1R, NPY2R NPY5R 1/4885KMT2A 2768/4885KDR 1712/4885
US-20110039802-A1 NPY Y5 ANTAGONIST NPY5R, NPY1R, NPY2R NPY5R 1/4885KMT2A 2953/4885KDR 1455/4885

“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.