SCHEMBL10116402

SCHEMBL10116402

Cc1cc(C(=O)NC(C)C)c(C)c(C)c1NC(=O)c1ccc(NS(=O)(=O)C(C)(C)C)cc1

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LMNA P02545 7/20 0.43
MAPT P10636 6/20 0.43
MEN1 O00255 4/20 0.43
KMT2A Q03164 4/20 0.43
KDM4E B2RXH2 3/20 0.43
ALDH1A1 P00352 6/20 0.41
ACLY P53396 1/20 0.41
HTT P42858 2/20 0.39
CYP2D6 P10635 1/20 0.37
CYP2C19 P33261 1/20 0.37
PTGER4 P35408 1/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
MAPK1 P28482 2/20 0.35
HPGD P15428 3/20 0.35
MAPK10 P53779 1/20 0.35
TP53 P04637 1/20 0.35

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
SCHEMBL10116707 0.87 ACLY (0.40) LMNAMAPTMEN1KMT2AKDM4E
SCHEMBL10116350 0.87 ACLY (0.47) LMNAMAPTMEN1KMT2AKDM4E
SCHEMBL10116404 0.85 ACLY (0.42) LMNAMAPTMEN1KMT2AKDM4E
SCHEMBL17090459 0.83 GHSR (0.35) LMNAMAPTMEN1KMT2AKDM4E
SCHEMBL10116346 0.83 ALDH1A1 (0.41) LMNAMAPTMEN1KMT2AKDM4E
SCHEMBL10114588 0.80 LMNA (0.53) LMNAMAPTMEN1KMT2AKDM4E
SCHEMBL10116323 0.80 HPGD (0.47) MAPTMEN1KMT2AKDM4EALDH1A1
SCHEMBL10116414 0.79 MAPT (0.49) LMNAMAPTMEN1KMT2AKDM4E
SCHEMBL10116283 0.77 ACLY (0.46) LMNAMAPTMEN1KMT2AKDM4E
SCHEMBL10114497 0.76 HPGD (0.56) LMNAMAPTMEN1KMT2AKDM4E

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 LMNA 1925/4885MAPT 3602/4885MEN1 2876/4885
US-20100292500-A1 NPY Y5 ANTAGONIST NPY5R, NPY1R, NPY2R LMNA 2068/4885MAPT 3367/4885MEN1 2932/4885

“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.