SCHEMBL11069700

SCHEMBL11069700

Cc1nc2ccc3ccccc3c2n1CCN1CCN(c2ccccc2)CC1

nearest known ligand 0.57

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HTR7 P34969 6/20 0.57
HTR1A P08908 4/20 0.57
GAA P10253 1/20 0.51
DRD3 P35462 3/20 0.46
HRH3 Q9Y5N1 1/20 0.46
DRD2 P14416 2/20 0.46
SIGMAR1 Q99720 2/20 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
KCNH2 Q12809 2/20 0.44
ADRA1B P35368 2/20 0.43
PARP1 P09874 1/20 0.42

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
SCHEMBL11064227 0.81 HTR7 (0.52) HTR7HTR1AGAADRD3HRH3
SCHEMBL10601141 0.79 PDE10A (0.55) HTR7HTR1ADRD3HRH3DRD2
SCHEMBL11065358 0.78 TSHR (0.49) HTR7HTR1ADRD3HRH3DRD2
SCHEMBL11070029 0.77 HTR1A (0.48) HTR7HTR1ADRD3HRH3DRD2
SCHEMBL11366877 0.77 GRM2 (0.64) GAADRD3HRH3KDM4EALDH1A1
SCHEMBL11282844 0.77 PDE10A (0.53) HTR7HTR1ADRD3HRH3DRD2
SCHEMBL10602407 0.75 HTR1A (0.44) HTR7HTR1ADRD3HRH3DRD2
SCHEMBL11062672 0.74 MAPT (0.52) HTR7HTR1AGAAKDM4EALDH1A1
SCHEMBL11073089 0.73 PDE10A (0.48) HTR7HTR1ADRD3DRD2KDM4E
SCHEMBL11066340 0.72 DRD3 (0.57) HTR7HTR1ADRD3HRH3DRD2

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0034249-B1 NEW NAPHTHIMIDAZOLE AND NAPHTHOXAZOLE DERIVATIVES, THEIR PREPARATION, AND THEIR USE IN PHARMACEUTICALS GRUPPO LEPETIT S.P.A. (IT) 1984-10-24 EP disclosed
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
EP-0034249-A2 New naphthimidazole and naphthoxazole derivatives, their preparation, and their use in pharmaceuticals GRUPPO LEPETIT S.P.A. (IT) 1981-08-26 EP disclosed