SCHEMBL10355469

SCHEMBL10355469

CCN1CCC[C@@H]1CNC(=O)c1cc(Br)cc(OC)c1OC

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
DRD3 P35462 2/20 1.00
DRD2 P14416 3/20 0.81
DRD4 P21917 1/20 0.80
ABCG2 Q9UNQ0 1/20 0.73

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
SCHEMBL10355542 1.00 DRD3 (1.00) DRD3DRD2DRD4ABCG2
SCHEMBL5477770 1.00 DRD3 (1.00) DRD3DRD2DRD4ABCG2
SCHEMBL10355444 0.89 DRD2 (1.00) DRD3DRD2
SCHEMBL29959345 0.89 DRD3 (0.81) DRD3DRD2DRD4
SCHEMBL10355445 0.89 DRD2 (1.00) DRD3DRD2
SCHEMBL10355479 0.89 DRD2 (1.00) DRD3DRD2DRD4
SCHEMBL10355478 0.89 DRD2 (1.00) DRD3DRD2DRD4
SCHEMBL10355426 0.88 DRD2 (0.80) DRD3DRD2ABCG2
SCHEMBL10355427 0.88 DRD2 (0.80) DRD3DRD2ABCG2
SCHEMBL10762595 0.87 DRD3 (0.77) DRD3DRD2DRD4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0207913-B1 CATECHOL CARBOXAMIDES, PROCESS FOR THEIR PREPARATION, INTERMEDIATES AND A PHARMACEUTICAL PREPARATION Astra Läkemedel Aktiebolag (SE) 1990-10-31 EP disclosed
EP-0207913-A1 Catechol carboxamides, process for their preparation, intermediates and a pharmaceutical preparation Astra Läkemedel Aktiebolag (SE) 1987-01-07 EP disclosed
WO-1986007591-A1 CATECHOLCARBOXAMIDES, PROCESS FOR THEIR PREPARATION, INTERMEDIATES AND A PHARMACEUTICAL PREPARATION Astra Läkemedel Aktiebolag (SE) 1986-12-31 WO disclosed