SCHEMBL6575812

SCHEMBL6575812

c1ccc2nc(OCCN3CCCCC3)ccc2c1

nearest known ligand 0.86

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.86
MAPT P10636 1/20 0.86
KMT2A Q03164 1/20 0.86
SCN7A Q01118 1/20 0.56
SIGMAR1 Q99720 2/20 0.53
TSHR P16473 1/20 0.52
LTA4H P09960 7/20 0.52
TDP1 Q9NUW8 1/20 0.50
ACHE P22303 1/20 0.49
KCNH2 Q12809 1/20 0.49

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
SCHEMBL31033194 1.00 MEN1 (0.86) MEN1MAPTKMT2ASCN7ASIGMAR1
SCHEMBL16621435 0.81 SCN7A (0.60) MEN1MAPTKMT2ASCN7ASIGMAR1
SCHEMBL16621374 0.79 SCN7A (0.58) MEN1MAPTKMT2ASCN7ASIGMAR1
SCHEMBL4536226 0.79 SCN7A (0.58) MEN1MAPTKMT2ASCN7ASIGMAR1
SCHEMBL30117493 0.77 MEN1 (0.55) MEN1MAPTKMT2ALTA4HTDP1
SCHEMBL16621316 0.76 MEN1 (0.58) MEN1MAPTKMT2ASCN7ASIGMAR1
SCHEMBL25715589 0.76 SCN7A (0.55) MEN1MAPTKMT2ASCN7ASIGMAR1
Hydrochloric Acid SCHEMBL18109825 0.76 SCN7A (0.55) MEN1MAPTKMT2ASCN7ALTA4H
SCHEMBL31143565 0.75 LTA4H (0.71) TSHRLTA4HTDP1
SCHEMBL25274425 0.75 SCN7A (0.54) MEN1MAPTKMT2ASCN7ALTA4H

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-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 MEN1 2990/4885MAPT 2519/4885KMT2A 630/4885

“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.