SCHEMBL354648

SCHEMBL354648

CCc1nc(-c2ccc(N3CCN(C(=O)OC(C)(C)C)CC3)c(F)c2)no1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPY2R P49146 5/20 0.58
HDAC4 P56524 1/20 0.51
GPR119 Q8TDV5 3/20 0.49
DGAT1 O75907 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
MAPT P10636 2/20 0.46
ALDH1A1 P00352 1/20 0.46
GLA P06280 1/20 0.46
HSD17B10 Q99714 1/20 0.46
HDAC6 Q9UBN7 2/20 0.46
LMNA P02545 1/20 0.46
MAPK1 P28482 1/20 0.46
HDAC1 Q13547 1/20 0.45
HDAC8 Q9BY41 1/20 0.45
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
CYP1A2 P05177 1/20 0.44
CYP2D6 P10635 1/20 0.44
CYP2C9 P11712 1/20 0.44
CYP2C19 P33261 1/20 0.44

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
SCHEMBL8221031 0.87 GPR119 (0.56) NPY2RHDAC4GPR119L3MBTL1MAPT
SCHEMBL355493 0.85 HTT (0.52) NPY2RHDAC4GPR119L3MBTL1MAPT
SCHEMBL355575 0.85 GPR119 (0.56) NPY2RHDAC4GPR119L3MBTL1MAPT
SCHEMBL355505 0.85 HDAC4 (0.51) NPY2RHDAC4GPR119L3MBTL1MAPT
SCHEMBL8226671 0.83 GPR119 (0.52) HDAC4GPR119MAPTALDH1A1GLA
SCHEMBL17115033 0.80 HDAC4 (0.54) HDAC4GPR119MAPTHDAC6LMNA
SCHEMBL354865 0.79 GPR119 (0.55) NPY2RHDAC4GPR119L3MBTL1MAPT
SCHEMBL4103141 0.78 KMT2A (0.48) HDAC4GPR119DGAT1LMNAMAPK1
SCHEMBL8221449 0.78 HTT (0.52) HDAC4GPR119L3MBTL1MAPTALDH1A1
SCHEMBL356303 0.77 RBP4 (0.52) HDAC4GPR119L3MBTL1MAPTHDAC6

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-20120015957-A1 PIPERAZINYL DERIVATIVES USEFUL AS MODULATORS OF THE NEUROPEPTIDE Y2 RECEPTOR JANSSEN PHARMACEUTICA NV (BE) 2012-01-19 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-20120015957-A1 PIPERAZINYL DERIVATIVES USEFUL AS MODULATORS OF THE NEUROPEPTIDE Y2 RECEPTOR NPY2R, NPY1R, NPY5R NPY2R 1/4885HDAC4 2569/4885GPR119 58/4885

“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.