SCHEMBL7479891

SCHEMBL7479891

Fc1ccc2[nH]cc([C@H]3CC[C@H](NCc4ccccc4)CC3)c2c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 9/20 0.62
HTR1A P08908 5/20 0.62
OPRM1 P35372 2/20 0.50
OPRK1 P41145 2/20 0.50
OPRL1 P41146 2/20 0.50
DRD1 P21728 1/20 0.50
SLC6A2 P23975 1/20 0.50
HTR1B P28222 1/20 0.50
HTR2A P28223 1/20 0.50
SLC6A3 Q01959 1/20 0.50

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
SCHEMBL3889405 0.93 SLC6A4 (0.72) SLC6A4HTR1ADRD1SLC6A2HTR1B
SCHEMBL3884378 0.93 SLC6A4 (0.72) SLC6A4HTR1ADRD1SLC6A2HTR1B
SCHEMBL3896858 0.93 SLC6A4 (0.72) SLC6A4HTR1ADRD1SLC6A2HTR1B
SCHEMBL3889413 0.93 SLC6A4 (0.72) SLC6A4HTR1ADRD1SLC6A2HTR1B
SCHEMBL3898028 0.93 SLC6A4 (0.72) SLC6A4HTR1ADRD1SLC6A2HTR1B
SCHEMBL5785429 0.78 SLC6A4 (0.71) SLC6A4HTR1BHTR2A
SCHEMBL5784929 0.78 SLC6A4 (0.71) SLC6A4HTR1BHTR2A
SCHEMBL5785421 0.78 SLC6A4 (0.71) SLC6A4HTR1BHTR2A
SCHEMBL5784935 0.78 SLC6A4 (0.71) SLC6A4HTR1BHTR2A
SCHEMBL5784926 0.78 SLC6A4 (0.71) SLC6A4HTR1BHTR2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1160332-C N-aryloxyethylamine derivatives for treatment of depression 2004-08-04 CN disclosed
EP-1068184-B1 N-ARYLOXYETHYLAMINE DERIVATIVES FOR THE TREATMENT OF DEPRESSION WYETH CORP (US) 2002-09-04 EP disclosed
CN-1303373-A N-Aryloxyethylamine derivatives for treatment of depression AMERICAN HOME PROD (US) 2001-07-11 CN disclosed
EP-1068184-A1 N-ARYLOXYETHYLAMINE DERIVATIVES FOR THE TREATMENT OF DEPRESSION AMERICAN HOME PRODUCTS CORPORATION (US) 2001-01-17 EP disclosed
US-6110956-A ANTIDEPRESSANTS TREATING DISORDERS OF THE SEROTONIN-AFFECTED NEUROLOGICAL SYSTEMS AMERICAN HOME PRODUCTS CORP. (US) 2000-08-29 US disclosed
WO-1999051576-A1 N-ARYLOXYETHYLAMINE DERIVATIVES FOR THE TREATMENT OF DEPRESSION AMERICAN HOME PRODUCTS CORPORATION (US) 1999-10-14 WO disclosed