SCHEMBL6116123

SCHEMBL6116123

Cc1ccnc(Nc2ccc(N3CCN(C(c4ccccc4)c4ncco4)CC3)c(F)c2)n1

nearest known ligand 0.51

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ NPY2R P49146 13/20 0.51
▸ AXL P30530 2/20 0.41
▸ CDK4 P11802 2/20 0.40
▸ PIM1 P11309 1/20 0.40
▸ CCND3 P30281 1/20 0.40
▸ GSK3B P49841 1/20 0.40
▸ CSF1R P07333 1/20 0.40
▸ CDK6 Q00534 1/20 0.40
▸ SYK P43405 1/20 0.39
▸ JAK2 O60674 2/20 0.38
▸ JAK3 P52333 2/20 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
SCHEMBL6116034 0.89 NPY2R (0.51) NPY2RJAK2JAK3
SCHEMBL6115399 0.86 NPY2R (0.53) NPY2R
SCHEMBL6115385 0.84 NPY2R (0.49) NPY2R
SCHEMBL4432016 0.83 NPY2R (0.47) NPY2R
SCHEMBL4289549 0.81 NPY2R (0.60) NPY2R
SCHEMBL6115417 0.80 NPY2R (0.64) NPY2R
SCHEMBL4004080 0.79 ALDH1A1 (0.51) NPY2R
SCHEMBL8736778 0.78 NPY2R (0.77) NPY2R
SCHEMBL4148805 0.78 NPY2R (0.77) NPY2R
SCHEMBL6115374 0.78 NPY2R (0.60) NPY2R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120129870-A1 PIPERAZINYL DERIVATIVES USEFUL AS MODULATORS OF THE NEUROPEPTIDE Y2 RECEPTOR JANSSEN PHARMACEUTICA NV (BE) 2012-05-24 — — US disclosed
US-20120129870-A1 PIPERAZINYL DERIVATIVES USEFUL AS MODULATORS OF THE NEUROPEPTIDE Y2 RECEPTOR JANSSEN PHARMACEUTICA NV (BE) 2012-05-24 — — US disclosed
WO-2009079597-A1 PIPERAZINYL DERIVATIVES USEFUL AS MODULATORS OF THE NEUROPEPTIDE Y2 RECEPTOR JANSSEN PHARMACEUTICA N.V. (BE) 2009-06-25 — — WO 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-20120129870-A1 PIPERAZINYL DERIVATIVES USEFUL AS MODULATORS OF THE NEUROPEPTIDE Y2 RECEPTOR NPY2R, NPY1R, NPY5R NPY2R 1/4885AXL 816/4885CDK4 3650/4885

“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.

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