SCHEMBL6438236

SCHEMBL6438236

COc1ccccc1CC(O)(c1ccccc1)C1CNCCO1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 18/20 1.00
ADRA2C P18825 1/20 0.46
SLC6A4 P31645 6/20 0.43
SLC6A3 Q01959 3/20 0.43
ADRB2 P07550 1/20 0.39
HTR1A P08908 1/20 0.39
HTR2A P28223 1/20 0.39
ADRA1A P35348 1/20 0.39
HTR2B P41595 1/20 0.39
HRH1 P35367 1/20 0.39

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
SCHEMBL8283440 1.00 SLC6A2 (1.00) SLC6A2ADRA2CSLC6A4SLC6A3ADRB2
SCHEMBL14595288 1.00 SLC6A2 (1.00) SLC6A2ADRA2CSLC6A4SLC6A3ADRB2
SCHEMBL6469426 1.00 SLC6A2 (1.00) SLC6A2ADRA2CSLC6A4SLC6A3ADRB2
Hydrochloric Acid SCHEMBL5042869 0.99 SLC6A2 (1.00) SLC6A2ADRA2CSLC6A4SLC6A3ADRB2
Hydrochloric Acid SCHEMBL5042868 0.99 SLC6A2 (1.00) SLC6A2ADRA2CSLC6A4SLC6A3ADRB2
Hydrochloric Acid SCHEMBL5042313 0.99 SLC6A2 (1.00) SLC6A2ADRA2CSLC6A4SLC6A3ADRB2
SCHEMBL14203022 0.91 SLC6A2 (0.82) SLC6A2ADRA2CSLC6A4SLC6A3HRH1
SCHEMBL5042389 0.91 SLC6A2 (0.82) SLC6A2ADRA2CSLC6A4SLC6A3HRH1
Hydrochloric Acid SCHEMBL5048069 0.90 SLC6A2 (0.83) SLC6A2ADRA2CSLC6A4SLC6A3HRH1
Hydrochloric Acid SCHEMBL5042263 0.90 SLC6A2 (0.83) SLC6A2ADRA2CSLC6A4SLC6A3HRH1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1534694-A1 ARYL AND HETEROARYL MORPHOLINE DERIVATIVES ELI LILLY AND COMPANY (US) 2005-06-01 EP disclosed
WO-2004018441-A1 ARYL AND HETEROARYL MORPHOLINE DERIVATIVES ELI LILLY AND COMPANY (US) 2004-03-04 WO disclosed