SCHEMBL4046303

SCHEMBL4046303

O=C1OC2(CCN(c3nc(-c4cccc(C(F)(F)F)c4)c[nH]3)CC2)c2ccccc21

nearest known ligand 0.62

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
NPY5R Q15761 20/20 0.62

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
SCHEMBL4046261 0.87 NPY5R (0.64) NPY5R
Hydrochloric Acid SCHEMBL4047175 0.86 NPY5R (0.63) NPY5R
SCHEMBL4051760 0.85 NPY5R (0.64) NPY5R
Hydrochloric Acid SCHEMBL4048488 0.84 NPY5R (0.63) NPY5R
SCHEMBL4047937 0.83 NPY5R (0.56) NPY5R
SCHEMBL4043110 0.83 NPY5R (0.62) NPY5R
Hydrochloric Acid SCHEMBL4046017 0.82 NPY5R (0.56) NPY5R
Hydrochloric Acid SCHEMBL4499186 0.82 NPY5R (0.61) NPY5R
SCHEMBL4046448 0.81 NPY5R (0.60) NPY5R
SCHEMBL4044817 0.81 NPY5R (0.62) NPY5R

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
EP-1566384-B1 NOVEL AZOLE DERIVATIVES BANYU PHARMA CO LTD (JP) 2009-06-17 EP claimed
US-20060111380-A1 Novel azole derivatives MSD K.K. (JP) 2006-05-25 US claimed
EP-1566384-A1 NOVEL AZOLE DERIVATIVES BANYU PHARMACEUTICAL CO., LTD. (JP) 2005-08-24 EP claimed
US-7589096-B2 Azole derivatives BANYU PHARMACEUTICAL CO., LTD. (JP) 2009-09-15 US disclosed
EP-1566384-B1 NOVEL AZOLE DERIVATIVES BANYU PHARMA CO LTD (JP) 2009-06-17 EP disclosed
US-20080188507-A1 Novel azole derivatives MSD K.K. (JP) 2008-08-07 US disclosed
US-7365079-B2 Azole derivatives BANYU PHARMACEUTICAL CO., LTD. (JP) 2008-04-29 US disclosed
US-20060111380-A1 Novel azole derivatives MSD K.K. (JP) 2006-05-25 US disclosed
EP-1566384-A1 NOVEL AZOLE DERIVATIVES BANYU PHARMACEUTICAL CO., LTD. (JP) 2005-08-24 EP 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-20080188507-A1 Novel azole derivatives NPY1R, NPY5R, NPY2R NPY5R 2/4885
US-20060111380-A1 Novel azole derivatives NPY1R, NPY5R, NPY2R NPY5R 2/4885

“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.