SCHEMBL13085089

SCHEMBL13085089

C=C(Nc1ccc(N2CCC(C(C(=O)NCCC)c3ccccc3)CC2)cc1)c1ccccc1-c1cc(Cl)cc(Cl)c1

nearest known ligand 0.49

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ NPY2R P49146 12/20 0.49
▸ MTTP P55157 7/20 0.49
▸ KCNQ2 O43526 1/20 0.40
▸ EP300 Q09472 2/20 0.39
▸ KDM4E B2RXH2 1/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ GAA P10253 1/20 0.38
▸ MAPT P10636 1/20 0.38
▸ HTR1E P28566 1/20 0.38
▸ S1PR3 Q99500 1/20 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
SCHEMBL13085075 0.94 NPY2R (0.50) NPY2RMTTPKCNQ2ALDH1A1MAPT
SCHEMBL13084968 0.93 NPY2R (0.50) NPY2RMTTPKCNQ2EP300
SCHEMBL2582743 0.93 NPY2R (0.57) NPY2RMTTPKCNQ2EP300ALDH1A1
SCHEMBL12174513 0.86 NPY2R (0.58) NPY2RMTTPALDH1A1
SCHEMBL12174495 0.86 NPY2R (0.66) NPY2RMTTPKCNQ2ALDH1A1MAPT
SCHEMBL12174506 0.85 NPY2R (0.58) NPY2RMTTPKCNQ2EP300ALDH1A1
SCHEMBL13085262 0.84 NPY2R (0.46) NPY2RMTTPKCNQ2HTR1ES1PR3
SCHEMBL12174395 0.84 NPY2R (0.65) NPY2RMTTPKCNQ2GAA
SCHEMBL13085173 0.84 NPY2R (0.46) NPY2RMTTPKCNQ2KDM4EALDH1A1
SCHEMBL12174193 0.83 NPY2R (0.56) NPY2RMTTPALDH1A1MAPT

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
EP-1317431-B1 POLYARYLCARBOXAMIDES USEFUL AS LIPID LOWERING AGENTS JANSSEN PHARMACEUTICA NV (BE) 2010-10-20 — — EP disclosed
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