SCHEMBL1005217

SCHEMBL1005217

OS1(O)CCN(c2cc(CCl)nc(NCC(F)(F)F)c2)CC1

nearest known ligand 0.45

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
NPY1R P25929 6/20 0.45
KCNH2 Q12809 3/20 0.45
HRH4 Q9H3N8 4/20 0.39
ZAP70 P43403 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
SCHEMBL1002609 0.90 NPY1R (0.45) NPY1RKCNH2HRH4ZAP70
SCHEMBL1005218 0.89 NPY1R (0.45) NPY1RKCNH2HRH4ZAP70
SCHEMBL1002610 0.80 NPY1R (0.45) NPY1RKCNH2HRH4ZAP70
SCHEMBL1001849 0.78 NPY1R (0.57) NPY1RKCNH2
SCHEMBL1004422 0.78 NPY1R (0.59) NPY1RKCNH2
SCHEMBL1005109 0.78 NPY1R (0.41) NPY1RKCNH2HRH4
SCHEMBL13688206 0.72 NPY1R (0.47) NPY1RKCNH2HRH4ZAP70
SCHEMBL1004424 0.67 NPY1R (0.71) NPY1RKCNH2
SCHEMBL1003570 0.66 NPY1R (0.55) NPY1RKCNH2
SCHEMBL1003185 0.66 NPY1R (0.61) NPY1RKCNH2

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110015181-A1 ALKYLAMINOPYRIDINE DERIVATIVE BANYU PHARMACEUTICAL CO., LTD. (JP) 2011-01-20 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-20110015181-A1 ALKYLAMINOPYRIDINE DERIVATIVE NPY4R, NPY1R, NPY2R NPY1R 2/4885KCNH2 1295/4885HRH4 40/4885

“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.