SCHEMBL8504083

SCHEMBL8504083

CN1CCc2c(ccc3c2CCC3)C(c2cccc3ccoc23)C1

nearest known ligand 0.58

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 4/20 0.58
SLC6A4 P31645 4/20 0.58
SLC6A3 Q01959 4/20 0.58
DRD1 P21728 3/20 0.58
DRD5 P21918 1/20 0.34

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
SCHEMBL8504189 0.86 SLC6A2 (0.62) SLC6A2SLC6A4SLC6A3DRD1
SCHEMBL8505693 0.82 DRD1 (0.66) SLC6A2SLC6A4SLC6A3DRD1DRD5
SCHEMBL8504024 0.78 DRD1 (0.53) SLC6A2SLC6A4SLC6A3DRD1
SCHEMBL8504160 0.78 DRD1 (0.53) SLC6A2SLC6A4SLC6A3DRD1DRD5
SCHEMBL8504152 0.76 DRD1 (0.55) SLC6A2SLC6A4SLC6A3DRD1
Hydrochloric Acid SCHEMBL7267588 0.75 DRD1 (0.52) SLC6A2SLC6A4SLC6A3DRD1DRD5
SCHEMBL4301574 0.73 SLC6A2 (1.00) SLC6A2SLC6A4SLC6A3DRD1
SCHEMBL8506683 0.73 DRD1 (0.55) SLC6A2SLC6A4SLC6A3DRD1
SCHEMBL29602922 0.73 DRD1 (1.00) SLC6A2SLC6A4SLC6A3DRD1DRD5
SCHEMBL5138043 0.73 DRD1 (1.00) SLC6A2SLC6A4SLC6A3DRD1DRD5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0688320-B1 TRICYCLIC BENZODIAZEPINS, THEIR USE AND PREPARATION NOVO NORDISK AS (DK) 1999-05-06 EP claimed
EP-0688320-A1 TRICYCLIC BENZODIAZEPINS, THEIR USE AND PREPARATION NOVO NORDISK A/S (DK) 1995-12-27 EP claimed
WO-1994020472-A1 HETEROCYCLIC COMPOUNDS, THEIR USE AND PREPARATION NOVO NORDISK A/S (DK) 1994-09-15 WO claimed
EP-0688320-B1 TRICYCLIC BENZODIAZEPINS, THEIR USE AND PREPARATION NOVO NORDISK AS (DK) 1999-05-06 EP disclosed
EP-0688320-A1 TRICYCLIC BENZODIAZEPINS, THEIR USE AND PREPARATION NOVO NORDISK A/S (DK) 1995-12-27 EP disclosed
WO-1994020472-A1 HETEROCYCLIC COMPOUNDS, THEIR USE AND PREPARATION NOVO NORDISK A/S (DK) 1994-09-15 WO disclosed