SCHEMBL7605076

SCHEMBL7605076

CCNC(=O)C(c1ccccc1)C1CCN(c2ccc(NC(=O)C3CCOC3)cc2C#N)CC1

nearest known ligand 0.62

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
NPY2R P49146 19/20 0.62
MTTP P55157 5/20 0.52
KDM4E B2RXH2 1/20 0.43
MEN1 O00255 1/20 0.43
ALDH1A1 P00352 1/20 0.43
MAPT P10636 1/20 0.43
HPGD P15428 1/20 0.43
KMT2A Q03164 1/20 0.43
HSD17B10 Q99714 1/20 0.43

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
SCHEMBL7605100 1.00 NPY2R (0.62) NPY2RMTTPKDM4EMEN1ALDH1A1
SCHEMBL14537950 1.00 NPY2R (0.62) NPY2RMTTPKDM4EMEN1ALDH1A1
SCHEMBL7603935 0.89 NPY2R (0.58) NPY2RMTTPKDM4EMEN1ALDH1A1
SCHEMBL13890091 0.87 NPY2R (0.59) NPY2RKDM4EMEN1ALDH1A1MAPT
SCHEMBL13873633 0.87 NPY2R (0.59) NPY2RKDM4EMEN1ALDH1A1MAPT
SCHEMBL7600303 0.87 NPY2R (0.62) NPY2RMTTPALDH1A1HPGD
SCHEMBL5081650 0.84 NPY2R (0.75) NPY2RMTTP
SCHEMBL13873603 0.82 NPY2R (0.57) NPY2RKDM4EMEN1ALDH1A1MAPT
SCHEMBL14537895 0.80 NPY2R (0.80) NPY2R
SCHEMBL7607274 0.80 NPY2R (0.80) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8183239-B2 Substituted piperazines and piperidines as modulators of the neuropeptide Y2 receptor JANSSEN PHARMACEUTICA NV (BE) 2012-05-22 US disclosed