SCHEMBL9363643

SCHEMBL9363643

CCCCN(CCCC)CCNC(=O)c1ccc(-n2ccnc2)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD3 P35462 5/20 0.51
CYP3A4 P08684 3/20 0.50
HTT P42858 2/20 0.50
BAZ2B Q9UIF8 1/20 0.50
CYP4Z1 Q86W10 1/20 0.49
DRD2 P14416 4/20 0.48
ADRB2 P07550 1/20 0.48
ADRB1 P08588 1/20 0.48
ADRB3 P13945 1/20 0.48
MAPK1 P28482 3/20 0.47
SMN1; SMN2 Q16637 3/20 0.47
ALDH1A1 P00352 2/20 0.47
NFKB1 P19838 1/20 0.47
KCNH2 Q12809 1/20 0.47
CYP2C19 P33261 2/20 0.47
CYP1A2 P05177 1/20 0.47
CYP2D6 P10635 1/20 0.47
CYP19A1 P11511 1/20 0.47
CYP2C9 P11712 1/20 0.47
SLC22A2 O15244 1/20 0.47

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
SCHEMBL9364551 0.92 MAPK1 (0.49) DRD3CYP3A4HTTBAZ2BCYP4Z1
SCHEMBL9363661 0.91 ALDH1A1 (0.58) DRD3CYP3A4HTTBAZ2BCYP4Z1
Hydrochloric Acid SCHEMBL9363955 0.90 BLM (0.59) DRD3CYP3A4HTTBAZ2BCYP4Z1
SCHEMBL9363630 0.88 DRD3 (0.55) DRD3CYP3A4HTTBAZ2BCYP4Z1
Hydrochloric Acid SCHEMBL9364164 0.87 DRD3 (0.54) DRD3CYP3A4HTTBAZ2BCYP4Z1
Imidazole SCHEMBL10562843 0.87 POLB (0.47) DRD3HTTCYP4Z1DRD2ADRB2
SCHEMBL7068530 0.86 NAAA (0.63) DRD3CYP3A4HTTBAZ2BCYP4Z1
SCHEMBL4674989 0.85 CYP3A4 (0.60) DRD3CYP3A4HTTBAZ2BCYP4Z1
SCHEMBL10566567 0.84 CYP19A1 (0.49) DRD3CYP3A4HTTBAZ2BCYP4Z1
Imidazole SCHEMBL10565485 0.81 POLB (0.46) DRD3HTTCYP4Z1DRD2ADRB2

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-0290377-B1 Substituted 4-[1H-Imidazol-1-yl] benzamides as antiarrhythmic agents SCHERING AG (DE) 1994-03-02 EP disclosed