SCHEMBL5196341

SCHEMBL5196341

CS(=O)(=O)Nc1cccc(N2CCN(Cc3c[nH]c4ccccc34)CC2)c1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ DRD2 P14416 6/20 0.63
▸ DRD4 P21917 6/20 0.63
▸ DRD3 P35462 6/20 0.63
▸ L3MBTL1 Q9Y468 1/20 0.55
▸ BCHE P06276 1/20 0.55
▸ CYP2D6 P10635 1/20 0.55
▸ HTR6 P50406 1/20 0.53
▸ LMNA P02545 3/20 0.53
▸ HTT P42858 3/20 0.53
▸ GAA P10253 1/20 0.53
▸ KDM4E B2RXH2 2/20 0.52
▸ ALDH1A1 P00352 2/20 0.52
▸ TDP1 Q9NUW8 1/20 0.52
▸ POLB P06746 1/20 0.51
▸ TSHR P16473 1/20 0.51
▸ MAPK1 P28482 1/20 0.49
▸ MAPT P10636 1/20 0.48
▸ JAK2 O60674 1/20 0.48
▸ RAB9A P51151 1/20 0.48
▸ HTR7 P34969 2/20 0.48

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
SCHEMBL5197511 0.91 DRD2 (0.61) DRD2DRD4DRD3L3MBTL1BCHE
SCHEMBL5198662 0.89 DRD4 (0.67) DRD2DRD4DRD3L3MBTL1BCHE
SCHEMBL5198056 0.85 DRD4 (0.66) DRD2DRD4DRD3CYP2D6HTR6
SCHEMBL5198433 0.83 DRD2 (0.61) DRD2DRD4DRD3L3MBTL1BCHE
SCHEMBL22609031 0.81 DRD2 (0.60) DRD2DRD4DRD3BCHECYP2D6
SCHEMBL5199698 0.79 DRD4 (0.65) DRD2DRD4DRD3L3MBTL1BCHE
SCHEMBL5198222 0.79 DRD3 (0.61) DRD2DRD4DRD3L3MBTL1CYP2D6
SCHEMBL5198915 0.79 DRD2 (0.60) DRD2DRD4DRD3L3MBTL1CYP2D6
SCHEMBL5198313 0.78 DRD2 (0.70) DRD2DRD4DRD3L3MBTL1BCHE
SCHEMBL5198067 0.77 DRD4 (0.64) DRD2DRD4DRD3CYP2D6HTR6

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-1815866-A1 REMEDY OR PREVENTIVE FOR ISCHEMIC CARDIAC DISEASE OR ISCHEMIC CARDIAC MYOPATHY Neugen Pharma, Inc (JP) 2007-08-08 — — EP disclosed
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