SCHEMBL6637435

SCHEMBL6637435

N#Cc1ccc2c(C3CCC(=O)CC3)c[nH]c2c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 2/20 0.58
SLC6A4 P31645 14/20 0.50
SLC6A2 P23975 2/20 0.47
SLC6A3 Q01959 2/20 0.47
HTR1A P08908 1/20 0.47
DRD1 P21728 1/20 0.47
HTR1B P28222 1/20 0.47
HTR2A P28223 1/20 0.47
HTR6 P50406 1/20 0.47
GABRP O00591 1/20 0.44
GABRD O14764 1/20 0.44
GABRA1 P14867 1/20 0.44
GABRB1 P18505 1/20 0.44
GABRG2 P18507 1/20 0.44
GABRB3 P28472 1/20 0.44
GABRA5 P31644 1/20 0.44
GABRA3 P34903 1/20 0.44
GABRA2 P47869 1/20 0.44
GABRB2 P47870 1/20 0.44
GABRA4 P48169 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
SCHEMBL5792377 0.89 SLC6A4 (0.63) IDO1SLC6A4SLC6A2SLC6A3HTR1A
Ethylene SCHEMBL7484426 0.87 SLC6A4 (0.60) IDO1SLC6A4SLC6A2SLC6A3HTR1A
SCHEMBL8298760 0.85 HTR2C (0.59) IDO1SLC6A4SLC6A2SLC6A3HTR1A
SCHEMBL3889321 0.82 SLC6A4 (0.60) IDO1SLC6A4SLC6A2SLC6A3HTR1A
SCHEMBL6087602 0.82 SLC6A4 (0.60) IDO1SLC6A4SLC6A2SLC6A3HTR1A
SCHEMBL6086690 0.82 SLC6A4 (0.60) IDO1SLC6A4SLC6A2SLC6A3HTR1A
SCHEMBL8301752 0.80 IDO1 (0.53) IDO1SLC6A4SLC6A2SLC6A3HTR1A
SCHEMBL6636763 0.79 DRD2 (0.57) IDO1SLC6A4SLC6A2SLC6A3HTR1A
SCHEMBL16801714 0.78 KDM4E (0.65) IDO1SLC6A4SLC6A2SLC6A3HTR1A
Ethylene SCHEMBL7483250 0.77 DRD2 (0.55) IDO1SLC6A4SLC6A2SLC6A3HTR1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1166636-C Arylpiperazinyl-cyclohexylindole derivatives for the treatment of depression 2004-09-15 CN disclosed
EP-1147083-B1 ARYLPIPERAZINYL-CYCLOHEXYL INDOLE DERIVATIVES FOR THE TREATMENT OF DEPRESSION WYETH CORP (US) 2004-06-16 EP disclosed
US-6465482-B2 ANTIDEPRESSANTS; ANXIOLYTIC AGENTS; SEROTONIN-AFFECTED NERVOUS SYSTEM DISORDERS; ACTING AT THE 5-HT1A AUTORECEPTORS CONCOMMITANTLY WITH 5-HT TRANSPORTERS; ANTISEROTONIN AGENTS; SEROTONIN REUPTAKE INHIBITORS; HT3 RECEPTOR ANTAGONISTS WYETH 2002-10-15 US disclosed
CN-1336916-A Arylpiperazinyl-cyclohexyl indole derivatives for the treatment of depression AMERICAN HOME PROD (US) 2002-02-20 CN disclosed
US-6313126-B1 FOR THRERAPY OF DISORDERS ASSOCIATED WITH DYSFUNCTION IN SEROTONERGIC NEUROTRANSMISSION, INCLUDING DEPRESSION AND ANXIETY AMERICAN HOME PRODUCTS CORP 2001-11-06 US disclosed
EP-1147083-A1 ARYLPIPERAZINYL-CYCLOHEXYL INDOLE DERIVATIVES FOR THE TREATMENT OF DEPRESSION AMERICAN HOME PRODUCTS CORPORATION (US) 2001-10-24 EP disclosed
WO-2000040554-A1 ARYLPIPERAZINYL-CYCLOHEXYL INDOLE DERIVATIVES FOR THE TREATMENT OF DEPRESSION AMERICAN HOME PRODUCTS CORPORATION (US) 2000-07-13 WO disclosed