SCHEMBL11064227

SCHEMBL11064227

Cc1nc2c3ccccc3ccc2n1CCN1CCN(c2ccccc2)CC1

nearest known ligand 0.52

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HTR7 P34969 6/20 0.52
HTR1A P08908 4/20 0.52
DRD3 P35462 3/20 0.48
ADRA1B P35368 3/20 0.48
HRH3 Q9Y5N1 1/20 0.46
DRD2 P14416 2/20 0.46
SIGMAR1 Q99720 1/20 0.46
GAA P10253 1/20 0.46
KDM4E B2RXH2 1/20 0.45
ALDH1A1 P00352 1/20 0.45
MAPT P10636 1/20 0.45
HPGD P15428 1/20 0.45
HTT P42858 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
LMNA P02545 1/20 0.45
ADRA1D P25100 1/20 0.45
ADRA1A P35348 1/20 0.45
PIK3C2B O00750 3/20 0.44

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
SCHEMBL11069700 0.81 HTR7 (0.57) HTR7HTR1ADRD3ADRA1BHRH3
SCHEMBL11069704 0.79 HTR1A (0.50) HTR7HTR1ADRD3HRH3DRD2
SCHEMBL11060823 0.76 TLR8 (0.54) HTR7HTR1ADRD3HRH3DRD2
SCHEMBL7081243 0.72 HTR7 (0.67) HTR7HTR1ADRD3DRD2HTT
SCHEMBL13711982 0.71 DRD3 (0.60) HTR7HTR1ADRD3ADRA1BHRH3
SCHEMBL9041083 0.71 KCNH2 (0.80) HTR7HTR1ADRD3DRD2SIGMAR1
SCHEMBL11065952 0.69 PARP1 (0.53) HTR7HTR1ADRD3HRH3DRD2
SCHEMBL8340386 0.69 HTR7 (0.57) HTR7HTR1ADRD3DRD2SIGMAR1
SCHEMBL10644015 0.68 KDM4E (0.49) KDM4EALDH1A1MAPTTDP1LMNA
Hydrochloric Acid SCHEMBL11454781 0.68 DRD3 (0.53) HTR7HTR1ADRD3DRD2ALDH1A1

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-4461894-A Naphth[1,2-d]imidazoles GRUPPO LEPETIT S.P.A. (IT) 1984-07-24 US disclosed
US-4360674-A Naphth[1,2-d]imidazoles GRUPPO LEPETIT S.P.A. (IT) 1982-11-23 US disclosed