SCHEMBL6574432

SCHEMBL6574432

FC(F)(F)c1cccc(OCCN2C3C=C(c4ccc5ccccc5c4)CC2CC3)c1

nearest known ligand 0.63

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 5/20 0.60
SLC6A4 P31645 2/20 0.46
HRH3 Q9Y5N1 1/20 0.46
HTR7 P34969 1/20 0.41
KDM4E B2RXH2 1/20 0.40
ALDH1A1 P00352 1/20 0.40
LMNA P02545 1/20 0.40
GAA P10253 1/20 0.40
HTT P42858 1/20 0.40
KMT2A Q03164 1/20 0.40
LTA4H P09960 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.38
SLC6A2 P23975 1/20 0.38
SLC6A3 Q01959 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
SCHEMBL6574430 1.00 HTR1A (0.60) HTR1ASLC6A4HRH3HTR7KDM4E
SCHEMBL6573625 0.77 HTR1A (0.67) HTR1ASLC6A4SLC6A2SLC6A3
SCHEMBL6575327 0.76 HTR1A (0.57) HTR1ASLC6A4SLC6A2SLC6A3
SCHEMBL6574408 0.76 HTR1A (0.57) HTR1ASLC6A4SLC6A2SLC6A3
SCHEMBL6575331 0.76 HTR1A (0.57) HTR1ASLC6A4SLC6A2SLC6A3
SCHEMBL6574406 0.76 HTR1A (0.57) HTR1ASLC6A4SLC6A2SLC6A3
SCHEMBL6574484 0.76 HTR1A (0.57) HTR1ASLC6A4SLC6A2SLC6A3
SCHEMBL6575264 0.75 HTR1A (0.65) HTR1ASLC6A4
SCHEMBL6575254 0.75 HTR1A (0.65) HTR1ASLC6A4
SCHEMBL6577432 0.75 HTR1A (1.00) HTR1ASLC6A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1390364-B1 ARYL-8-AZABICYCLO 3.2.1]OCTANES FOR THE TREATMENT OF DEPRESSION WYETH CORP (US) 2004-09-29 EP claimed
EP-1390364-A1 ARYL-8-AZABICYCLO 3.2.1]OCTANES FOR THE TREATMENT OF DEPRESSION Wyeth (US) 2004-02-25 EP claimed
US-6632824-B2 Have the ability to act at the 5-HT transporter. WYETH 2003-10-14 US claimed
US-20030032645-A1 Aryl-8-azabicyclo [3.2.1] octanes for the treatment of depression WYETH 2003-02-13 US claimed
WO-2002096906-A1 ARYL-8-AZABICYCLO[3.2.1]OCTANES FOR THE TREATMENT OF DEPRESSION WYETH (US) 2002-12-05 WO claimed
EP-1390364-B1 ARYL-8-AZABICYCLO 3.2.1]OCTANES FOR THE TREATMENT OF DEPRESSION WYETH CORP (US) 2004-09-29 EP disclosed
EP-1390364-A1 ARYL-8-AZABICYCLO 3.2.1]OCTANES FOR THE TREATMENT OF DEPRESSION Wyeth (US) 2004-02-25 EP disclosed
US-6632824-B2 Have the ability to act at the 5-HT transporter. WYETH 2003-10-14 US disclosed
US-20030032645-A1 Aryl-8-azabicyclo [3.2.1] octanes for the treatment of depression WYETH 2003-02-13 US disclosed
WO-2002096906-A1 ARYL-8-AZABICYCLO[3.2.1]OCTANES FOR THE TREATMENT OF DEPRESSION WYETH (US) 2002-12-05 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20030032645-A1 Aryl-8-azabicyclo [3.2.1] octanes for the treatment of depression HTR1A, HTR1D, HTR2C HTR1A 1/4885SLC6A4 90/4885HRH3 1181/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.