SCHEMBL11215258

SCHEMBL11215258

CN1CCc2cc(O)c(O)c(Sc3ccc(O)cc3)c2CC1

nearest known ligand 0.80

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ DRD2 P14416 11/20 0.42
▸ DRD1 P21728 11/20 0.42
▸ DRD5 P21918 11/20 0.42
▸ DRD3 P35462 9/20 0.42
▸ DRD4 P21917 5/20 0.38

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
SCHEMBL11168905 0.90 PRNP (0.39) DRD2DRD1DRD5DRD3DRD4
SCHEMBL11216598 0.89 DRD2 (0.41) DRD2DRD1DRD5DRD3DRD4
SCHEMBL11162257 0.89 PTPN2 (0.38) DRD2DRD1DRD5DRD3DRD4
SCHEMBL10471907 0.89 DRD1 (0.44) DRD2DRD1DRD5DRD3DRD4
Bromide SCHEMBL11159318 0.88 DRD1 (0.47) DRD2DRD1DRD5DRD3DRD4
SCHEMBL11216603 0.87 DRD1 (0.43) DRD2DRD1DRD5DRD3DRD4
SCHEMBL11155830 0.86 KDM4E (0.38) DRD2DRD1DRD5DRD3DRD4
SCHEMBL11167334 0.84 ALDH1A1 (0.40) —
SCHEMBL11214820 0.83 DRD2 (0.36) DRD2DRD1DRD5DRD3DRD4
Fumaric Acid SCHEMBL11380659 0.79 SMN1; SMN2 (0.39) DRD2DRD1DRD5

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-0080012-A1 6-Chloro-3-methyl-2,3,4,5-tetrahydro-1H-3-benzazepine, its acid addition salts and its use as an intermediate SMITHKLINE BECKMAN CORPORATION (US) 1983-06-01 — — EP disclosed
US-4265890-A ANTIPSYCHOTIC, ANTIEMETICS SMITHKLINE CORPORATION (US) 1981-05-05 — — US disclosed
EP-0007070-A1 2,3,4,5-Tetrahydro-1H-3-Benzazepines, process for their production and pharmaceutical compositions having dopamine receptor blocking activity SMITHKLINE BECKMAN CORPORATION (US) 1980-01-23 — — EP disclosed
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