SCHEMBL4715019

SCHEMBL4715019

O=C1O[C@]2(CC[C@](O)(C(=O)Nc3ccn(-c4ccc(F)cc4)n3)CC2)c2c1ccc[n+]2[O-]

nearest known ligand 0.49

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
NPY5R Q15761 6/20 0.49
ELOVL1 Q9BW60 14/20 0.42
DRD3 P35462 1/20 0.38

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
SCHEMBL4715013 1.00 NPY5R (0.49) NPY5RELOVL1DRD3
SCHEMBL4714629 0.86 NPY5R (0.66) NPY5RELOVL1DRD3
SCHEMBL4714625 0.86 NPY5R (0.66) NPY5RELOVL1DRD3
SCHEMBL4718162 0.84 NPY5R (0.54) NPY5RELOVL1DRD3
SCHEMBL4718159 0.84 NPY5R (0.54) NPY5RELOVL1DRD3
SCHEMBL4713339 0.82 NPY5R (0.53) NPY5RELOVL1DRD3
SCHEMBL4713343 0.82 NPY5R (0.53) NPY5RELOVL1DRD3
SCHEMBL4713860 0.79 NPY5R (0.75) NPY5RELOVL1DRD3
SCHEMBL4713857 0.79 NPY5R (0.75) NPY5RELOVL1DRD3
SCHEMBL4718222 0.79 NPY5R (0.53) NPY5RELOVL1

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
EP-1483266-B1 SPIRO COMPOUNDS WITH NPY ANTAGONISTIC ACTIVITY BANYU PHARMA CO LTD (JP) 2008-02-27 EP claimed
US-20050032820-A1 Novel spiro compounds MSD K.K. (JP) 2005-02-10 US claimed
EP-1483266-B1 SPIRO COMPOUNDS WITH NPY ANTAGONISTIC ACTIVITY BANYU PHARMA CO LTD (JP) 2008-02-27 EP disclosed
US-7304072-B2 E.g.,cis-N-(4-benzoylphenyl)-4-hydroxy-3'-oxospiro[cyclohexane-1,1'(3'H)-isobenzofuran]-4-carboxamide; useful as neuropeptide Y receptor antagonists and as agents for therapy of cardiovascular disorders, central nervous system disorders, metabolic diseases, respiratory and urogenital disorders BANYU PHARMACEUTICAL CO., LTD. (JP) 2007-12-04 US disclosed
US-20050032820-A1 Novel spiro compounds MSD K.K. (JP) 2005-02-10 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-20050032820-A1 Novel spiro compounds NR3C2, GPR119, NPY2R NPY5R 62/4885ELOVL1 686/4885DRD3 659/4885

“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.