SCHEMBL7267186

SCHEMBL7267186

CN1CCc2c(sc(CO)c2Br)C(c2ccccc2)C1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD1 P21728 14/20 0.52
DRD2 P14416 6/20 0.52
DRD5 P21918 2/20 0.45
HSD17B10 Q99714 2/20 0.45
CYP1A2 P05177 1/20 0.45
CYP2D6 P10635 1/20 0.45
TSHR P16473 1/20 0.45
CYP2C19 P33261 1/20 0.45
ADCY2 Q08462 1/20 0.45
MAPK1 P28482 2/20 0.44
HTR2A P28223 2/20 0.44
LMNA P02545 1/20 0.44
ADRA2A P08913 1/20 0.44
ADRA2B P18089 1/20 0.44
ADRA2C P18825 1/20 0.44
SLC6A2 P23975 1/20 0.44
HTR1B P28222 1/20 0.44
HTR2C P28335 1/20 0.44
SLC6A4 P31645 1/20 0.44
HTR7 P34969 1/20 0.44

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
SCHEMBL7266679 0.86 DRD1 (0.54) DRD1DRD2DRD5HSD17B10CYP1A2
SCHEMBL7268264 0.84 DRD1 (0.44) DRD1DRD2DRD5HSD17B10CYP1A2
SCHEMBL7266471 0.84 DRD1 (0.54) DRD1DRD2DRD5HSD17B10CYP1A2
Hydrochloric Acid SCHEMBL7290848 0.83 DRD1 (0.53) DRD1DRD2DRD5HSD17B10CYP1A2
SCHEMBL7276990 0.83 DRD1 (0.56) DRD1DRD2DRD5HSD17B10CYP1A2
SCHEMBL7267025 0.80 DRD1 (0.50) DRD1DRD2DRD5HSD17B10CYP1A2
Hydrochloric Acid SCHEMBL10413117 0.79 DRD1 (0.50) DRD1DRD2DRD5HSD17B10CYP1A2
SCHEMBL10414549 0.77 DRD1 (0.49) DRD1DRD2DRD5HSD17B10CYP1A2
SCHEMBL7267640 0.76 DRD1 (0.53) DRD1DRD2DRD5HSD17B10CYP1A2
Hydrochloric Acid SCHEMBL7299250 0.76 DRD1 (0.56) DRD1DRD2DRD5HSD17B10CYP1A2

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-0324610-B1 Thieno[2,3-d]azepine derivatives, process for their preparation and pharmaceutical compositions containing them LILLY INDUSTRIES LTD (GB) 1994-04-13 EP disclosed
US-4904653-A Thieno[2,3-O]azepine compounds and CNS affecting use thereof LILLY INDUSTRIES LIMITED (GB) 1990-02-27 US disclosed
EP-0324610-A2 Thieno[2,3-d]azepine derivatives, process for their preparation and pharmaceutical compositions containing them LILLY INDUSTRIES LIMITED (GB) 1989-07-19 EP disclosed