SCHEMBL10114945

SCHEMBL10114945

Cc1cc(NC(=O)C2CCC(NS(=O)(=O)C(C)C)CC2)c(C)c(C(=O)NC(C)C)c1

nearest known ligand 0.38

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 2/20 0.38
LMNA P02545 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
GAA P10253 2/20 0.36
KMT2A Q03164 1/20 0.36
KDM4E B2RXH2 2/20 0.35
GRIA2 P42262 3/20 0.35
ALDH1A1 P00352 2/20 0.34
THRB P10828 1/20 0.34
POLB P06746 1/20 0.34
L3MBTL1 Q9Y468 2/20 0.33
RECQL P46063 1/20 0.33
NR3C1 P04150 1/20 0.33

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
SCHEMBL13204428 1.00 BRD4 (0.38) BRD4LMNANPSR1GAAKMT2A
SCHEMBL10116138 0.84 CCR8 (0.43) LMNAGAAKMT2ATHRBPOLB
SCHEMBL10114925 0.83 GRIA2 (0.35) BRD4LMNANPSR1KMT2AGRIA2
SCHEMBL13204424 0.83 GRIA2 (0.35) BRD4LMNANPSR1KMT2AGRIA2
SCHEMBL14418515 0.82 GRIA2 (0.39) BRD4LMNAKDM4EGRIA2ALDH1A1
SCHEMBL14424390 0.82 GRIA2 (0.39) BRD4LMNAKDM4EGRIA2ALDH1A1
SCHEMBL17090544 0.82 MAPK14 (0.37) KMT2AGRIA2L3MBTL1NR3C1
SCHEMBL14424261 0.80 NPSR1 (0.48) LMNANPSR1GAAKMT2AGRIA2
SCHEMBL10114813 0.80 NPSR1 (0.48) LMNANPSR1GAAKMT2AGRIA2
SCHEMBL13204439 0.79 SMN1; SMN2 (0.42) GAAKMT2AKDM4EGRIA2ALDH1A1

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 BRD4 1776/4885LMNA 2068/4885NPSR1 8/4885

“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.