SCHEMBL6637142

SCHEMBL6637142

Cn1cc(C2CCC(=O)CC2)c2ccc(F)cc21

nearest known ligand 0.64

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 2/20 0.64
SLC6A4 P31645 2/20 0.64
HTR6 P50406 1/20 0.47
APP P05067 1/20 0.46
SCN9A Q15858 5/20 0.42
SCN5A Q14524 2/20 0.42
RORC P51449 4/20 0.40
AVPR2 P30518 1/20 0.39
AVPR1A P37288 1/20 0.39
AVPR1B P47901 1/20 0.39
CNR2 P34972 1/20 0.39
ATM Q13315 1/20 0.38
KDM4E B2RXH2 1/20 0.38
ALDH1A1 P00352 1/20 0.38

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
SCHEMBL6636952 0.89 DRD2 (0.64) DRD2SLC6A4HTR6RORCKDM4E
SCHEMBL22491537 0.82 APP (0.66) DRD2SLC6A4HTR6APPSCN9A
SCHEMBL3889328 0.81 DRD2 (0.58) DRD2SLC6A4HTR6RORCKDM4E
SCHEMBL6639237 0.80 SLC6A4 (0.43) DRD2SLC6A4HTR6APPSCN9A
SCHEMBL6663571 0.80 LMNA (0.51) DRD2SLC6A4HTR6KDM4EALDH1A1
SCHEMBL22871579 0.78 DRD2 (0.61) DRD2SLC6A4HTR6APPSCN9A
SCHEMBL29104142 0.77 DRD2 (0.51) DRD2SLC6A4HTR6APPSCN9A
Hydrochloric Acid SCHEMBL21518455 0.77 DRD2 (0.60) DRD2SLC6A4HTR6APPSCN9A
SCHEMBL12051155 0.77 SCN9A (0.53) DRD2SLC6A4HTR6APPSCN9A
SCHEMBL12927834 0.77 DRD2 (0.41) DRD2SLC6A4HTR6APPSCN9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
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