SCHEMBL30704356

SCHEMBL30704356

Cc1cc(=O)oc2cc(OCCCCN3CCc4c(c5ccccc5n4C)C3)ccc12

nearest known ligand 0.62

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HTR5A P47898 8/20 0.61
HTR1A P08908 1/20 0.57
DRD2 P14416 1/20 0.57
DRD3 P35462 1/20 0.57
KCNH2 Q12809 1/20 0.57
ALDH1A1 P00352 1/20 0.56
LMNA P02545 1/20 0.56
MAPT P10636 1/20 0.56
HPGD P15428 1/20 0.56
MAPK1 P28482 1/20 0.56
SMN1; SMN2 Q16637 1/20 0.56
MAOB P27338 1/20 0.56
ABCB1 P08183 1/20 0.54
ABCC1 P33527 1/20 0.54

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
SCHEMBL29133438 1.00 HTR5A (0.61) HTR5AHTR1ADRD2DRD3KCNH2
SCHEMBL29133409 0.89 HTR5A (0.64) HTR5ADRD2DRD3MAOB
SCHEMBL30704357 0.89 HTR5A (0.64) HTR5ADRD2DRD3MAOB
SCHEMBL29133426 0.79 HTR5A (0.65) HTR5A
SCHEMBL30704343 0.78 HTR5A (0.64) HTR5AHTR1ADRD2DRD3
SCHEMBL29133417 0.77 MAOA (0.68) HTR5AHTR1ADRD2DRD3MAOB
SCHEMBL30704366 0.77 MAOA (0.68) HTR5AHTR1ADRD2DRD3MAOB
SCHEMBL30704344 0.77 HTR5A (0.61) HTR5AHTR1ADRD2DRD3
SCHEMBL30704360 0.75 HTR5A (0.65) HTR5A
SCHEMBL30704333 0.74 HTR5A (0.66) HTR5A

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
CN-117327065-A Carbazole derivatives as dopamine D2/3 receptor modulators 北京大学 2024-01-02 CN claimed
CN-117327065-A Carbazole derivatives as dopamine D2/3 receptor modulators 北京大学 2024-01-02 CN disclosed