SCHEMBL10134451

SCHEMBL10134451

Cc1c(CF)cnc(NC(=O)[C@H]2CC[C@H](NS(=O)(=O)C(C)C)CC2)c1C

nearest known ligand 0.39

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GRIA2 P42262 9/20 0.39
NPY5R Q15761 1/20 0.39
ABL1 P00519 6/20 0.36
AAK1 Q2M2I8 1/20 0.35
GSK3B P49841 1/20 0.35
DYRK1A Q13627 1/20 0.35
JAK1 P23458 1/20 0.32

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
SCHEMBL13222651 0.84 GSK3B (0.38) GRIA2GSK3BDYRK1A
SCHEMBL10114955 0.83 NPY5R (0.45) GRIA2NPY5RABL1AAK1GSK3B
SCHEMBL10133536 0.81 CCR8 (0.37) GRIA2NPY5RJAK1
SCHEMBL10114953 0.77 NPY5R (0.53) GRIA2NPY5RABL1AAK1
SCHEMBL14424386 0.77 NPY5R (0.53) GRIA2NPY5RABL1AAK1
SCHEMBL14627691 0.73 GRIA2 (0.42) GRIA2NPY5RABL1AAK1
SCHEMBL10114818 0.73 GRIA2 (0.42) GRIA2NPY5RABL1AAK1
SCHEMBL10114823 0.72 GRIA2 (0.40) GRIA2NPY5RABL1AAK1
SCHEMBL14424639 0.72 GRIA2 (0.40) GRIA2NPY5RABL1AAK1
SCHEMBL10134454 0.71 POLB (0.47) GRIA2

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 GRIA2 334/4885NPY5R 1/4885ABL1 1150/4885

“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.