SCHEMBL5951080

SCHEMBL5951080

N#Cc1ccnc(C2=NC(c3ccc(F)cc3)(c3ccc(F)cc3)[C@@H](CCO)N2)c1

nearest known ligand 0.57

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
NPY5R Q15761 18/20 0.57
KCNH2 Q12809 7/20 0.57
PPARG P37231 1/20 0.34

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
SCHEMBL4478938 0.92 NPY5R (0.61) NPY5RKCNH2PPARG
SCHEMBL4470110 0.85 NPY5R (0.56) NPY5RKCNH2
SCHEMBL4467817 0.85 NPY5R (0.56) NPY5RKCNH2
SCHEMBL4463612 0.85 NPY5R (0.56) NPY5RKCNH2
SCHEMBL5950682 0.82 NPY5R (0.50) NPY5RKCNH2
SCHEMBL5951077 0.79 NPY5R (0.54) NPY5RKCNH2PPARG
SCHEMBL4476317 0.77 NPY5R (0.60) NPY5RKCNH2
SCHEMBL4474237 0.77 NPY5R (0.60) NPY5RKCNH2
SCHEMBL4462364 0.77 NPY5R (0.60) NPY5RKCNH2
SCHEMBL4466507 0.76 NPY5R (0.64) NPY5RKCNH2

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-7064142-B2 Imidazonline compounds BANYU PHARMACEUTICAL, CO., LTD. (JP) 2006-06-20 US disclosed
US-20030158418-A1 Novel imidazonline compounds MSD K.K. (JP) 2003-08-21 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-20030158418-A1 Novel imidazonline compounds NPY1R, NPY2R, GPR119 NPY5R 4/4885KCNH2 493/4885PPARG 348/4885

“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.