SCHEMBL7919382

SCHEMBL7919382

Cc1ccccc1C1CN(C)CCc2ccc(O)cc21

nearest known ligand 0.72

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
DRD1 P21728 16/20 0.72
HTR2A P28223 2/20 0.72
DRD5 P21918 6/20 0.55
MAPK1 P28482 1/20 0.52
THPO P40225 1/20 0.52
HIF1A Q16665 1/20 0.52
HSD17B10 Q99714 1/20 0.52
MTOR P42345 1/20 0.52
DRD2 P14416 3/20 0.51
KDM4E B2RXH2 1/20 0.51
MAPT P10636 1/20 0.51
BLM P54132 1/20 0.51
PMP22 Q01453 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
DRD3 P35462 2/20 0.49
DRD4 P21917 1/20 0.49

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
SCHEMBL7922422 0.86 DRD1 (0.70) DRD1HTR2ADRD5MAPK1THPO
SCHEMBL8085146 0.84 DRD1 (1.00) DRD1HTR2ADRD5MAPK1THPO
SCHEMBL9838068 0.84 DRD1 (1.00) DRD1HTR2ADRD5MAPK1THPO
SCHEMBL7919553 0.83 DRD1 (0.66) DRD1HTR2ADRD5MAPK1THPO
SCHEMBL9405364 0.82 DRD1 (0.59) DRD1HTR2ADRD5DRD2DRD3
SCHEMBL14502337 0.81 DRD1 (1.00) DRD1DRD5THPOHSD17B10DRD2
SCHEMBL7213025 0.78 DRD1 (0.60) DRD1HTR2ADRD5MAPK1THPO
SCHEMBL7919596 0.77 DRD1 (0.67) DRD1HTR2ADRD5MAPK1THPO
SCHEMBL16508939 0.76 DRD1 (0.76) DRD1HTR2ADRD5MAPK1THPO
SCHEMBL7919454 0.75 DRD1 (0.70) DRD1HTR2ADRD5MAPK1THPO

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
US-6211173-B1 Use of 2,3,4,5-tetrahydro-1H-3-benzazepines for the manufacture of a pharmaceutical composition for the treatment of sleep disorders CENES LIMITED (GB) 2001-04-03 US disclosed
EP-1011679-A1 USE OF 2,3,4,5-TETRAHYDRO-1H-3-BENZAZEPINES FOR THE MANUFACTURE OF A PHARMACEUTICAL COMPOSITION FOR THE TREATMENT OF SLEEP DISORDERS CeNes Limited (GB) 2000-06-28 EP disclosed
WO-1998040072-A1 USE OF 2,3,4,5-TETRAHYDRO-1H-3-BENZAZEPINES FOR THE MANUFACTURE OF A PHARMACEUTICAL COMPOSITION FOR THE TREATMENT OF SLEEP DISORDERS CENES LIMITED (GB) 1998-09-17 WO disclosed