SCHEMBL4564205

SCHEMBL4564205

CCC(CC)C(=O)Nc1cc(F)c(N2CCN(C(=O)OC(C)(C)C)CC2)c(F)c1

nearest known ligand 0.48

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
NPY2R P49146 12/20 0.48
SHMT2 P34897 1/20 0.44
GPR119 Q8TDV5 2/20 0.44
F13A1 P00488 1/20 0.43
TGM2 P21980 1/20 0.43
TGM1 P22735 1/20 0.43
DPP4 P27487 1/20 0.43
HTT P42858 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
LMNA P02545 1/20 0.41

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
SCHEMBL4004710 0.87 NPY2R (0.60) NPY2R
SCHEMBL18763033 0.80 TGM2 (0.65) GPR119F13A1TGM2TGM1
SCHEMBL5128217 0.79 SHMT2 (0.53) NPY2RSHMT2HTTNPSR1LMNA
SCHEMBL4011718 0.78 SHMT2 (0.49) NPY2RSHMT2HTTNPSR1LMNA
SCHEMBL17422197 0.77 GPR119 (0.53) GPR119F13A1TGM2TGM1DPP4
SCHEMBL6115001 0.77 NPY2R (0.59) NPY2RGPR119NPSR1
SCHEMBL2449157 0.76 BACE1 (0.50) GPR119
SCHEMBL24606792 0.76 GPR119 (0.49) GPR119DPP4LMNA
SCHEMBL2445935 0.76 GPR119 (0.49) GPR119DPP4LMNA
SCHEMBL18790571 0.76 F13A1 (0.48) GPR119F13A1TGM2TGM1DPP4

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-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 1/4885SHMT2 4057/4885GPR119 56/4885

“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.