SCHEMBL9429593

SCHEMBL9429593

Cn1c(N2CCN(CCC(=O)c3ccc(Cl)cc3)CC2)cc(=O)n(C)c1=O

nearest known ligand 0.59

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SOD1 P00441 1/20 0.57
HTR1A P08908 6/20 0.56
DRD4 P21917 3/20 0.55
KMT2A Q03164 5/20 0.54
ALDH1A1 P00352 3/20 0.54
MAPT P10636 2/20 0.54
LMNA P02545 1/20 0.53
HPGD P15428 1/20 0.53
TSHR P16473 1/20 0.53
HTT P42858 1/20 0.53
HRH1 P35367 5/20 0.49
DRD2 P14416 3/20 0.49
HTR2A P28223 2/20 0.49
HTR2C P28335 2/20 0.49
DRD3 P35462 2/20 0.49
MEN1 O00255 2/20 0.48
SIGMAR1 Q99720 1/20 0.46
HTR7 P34969 1/20 0.46
HTR2B P41595 1/20 0.46

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
SCHEMBL9428850 0.89 MEN1 (0.54) SOD1KMT2AALDH1A1MAPTLMNA
Hydrochloric Acid SCHEMBL9428878 0.88 MEN1 (0.53) SOD1DRD4KMT2AALDH1A1MAPT
SCHEMBL9429398 0.88 HTR1A (0.56) HTR1AKMT2AALDH1A1MAPTHRH1
Hydrochloric Acid SCHEMBL9428830 0.87 ALDH1A1 (0.56) HTR1AKMT2AALDH1A1MAPTHRH1
SCHEMBL9388604 0.84 KMT2A (0.60) SOD1HTR1AKMT2AALDH1A1MAPT
SCHEMBL9429617 0.81 TSHR (0.62) HTR1ADRD4KMT2AALDH1A1LMNA
SCHEMBL9428879 0.81 HTR1A (0.49) HTR1AKMT2AALDH1A1HRH1DRD2
SCHEMBL9428710 0.81 HRH1 (0.48) HRH1DRD2DRD3
Hydrochloric Acid SCHEMBL9429271 0.81 TSHR (0.65) HTR1ADRD4KMT2AALDH1A1LMNA
Hydrochloric Acid SCHEMBL9428097 0.80 HRH1 (0.47) KMT2ALMNAHRH1DRD2DRD3

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-5332739-A Pyrimidinedione derivatives and antiarrhythmic agents containing same MITSUI TOATSU CHEMICALS, INCORPORATED (JP) 1994-07-26 US disclosed
EP-0454498-A2 Pyrimidinedione derivatives and antiarrhythmic agents containing same MITSUI TOATSU CHEMICALS, Inc. (JP) 1991-10-30 EP disclosed