SCHEMBL1021872

SCHEMBL1021872

CN1C2C=C(c3ccc(Cl)c(Cl)c3)CC1CC2

nearest known ligand 0.63

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 6/20 0.62
SLC6A3 Q01959 5/20 0.62
SLC6A2 P23975 4/20 0.62
HTR6 P50406 1/20 0.48
HTR1A P08908 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
SCHEMBL1021870 1.00 SLC6A4 (0.62) SLC6A4SLC6A3SLC6A2HTR6HTR1A
Hydrochloric Acid SCHEMBL1023143 0.99 SLC6A4 (0.60) SLC6A4SLC6A3SLC6A2HTR6HTR1A
SCHEMBL2887016 0.89 SLC6A4 (0.59) SLC6A4SLC6A3SLC6A2HTR6HTR1A
SCHEMBL2890215 0.89 SLC6A4 (0.59) SLC6A4SLC6A3SLC6A2HTR6HTR1A
Hydrochloric Acid SCHEMBL2889969 0.87 SLC6A4 (0.58) SLC6A4SLC6A3SLC6A2HTR6HTR1A
SCHEMBL2886128 0.85 SLC6A4 (0.55) SLC6A4SLC6A3SLC6A2HTR6HTR1A
SCHEMBL2886131 0.85 SLC6A4 (0.55) SLC6A4SLC6A3SLC6A2HTR6HTR1A
SCHEMBL1021888 0.83 SLC6A2 (0.58) SLC6A4SLC6A3SLC6A2HTR6
Hydrochloric Acid SCHEMBL1023293 0.82 SLC6A2 (0.57) SLC6A4SLC6A3SLC6A2HTR6
SCHEMBL6553385 0.82 SLC6A4 (0.58) SLC6A4SLC6A3SLC6A2HTR6HTR1A

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 26 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2272847-A1 Enantiomers and their use as monoamine neurotransmitter re-uptake inhibitors NeuroSearch A/S (DK) 2011-01-12 EP claimed
US-20090137625-A1 Novel Enantiomers and Their Use as Monoamine Neurotransmitter Re-Uptake Inhibitors NEUROSEARCH A/S (DK) 2009-05-28 US claimed
EP-1869033-A1 NOVEL ENANTIOMERS AND THEIR USE AS MONOAMINE NEUROTRANSMITTER RE-UPTAKE INHIBITORS NEUROSEARCH A/S (DK) 2007-12-26 EP claimed
EP-0859777-B1 8-AZABICYCLO(3.2.1)OCT-2-ENE DERIVATIVES, THEIR PREPARATION AND USE NEUROSEARCH AS (DK) 2007-05-23 EP claimed
WO-2006108789-A1 NOVEL ENANTIOMERS AND THEIR USE AS MONOAMINE NEUROTRANSMITTER RE-UPTAKE INHIBITORS NEUROSEARCH A/S (DK) 2006-10-19 WO claimed
EP-1068204-A1 8-AZABICYCLO 3.2.1]OCT-2-ENE DERIVATIVES IN LABELLED AND USE OF 8-AZABICYCLO 3.2.1]OCT-2-ENE DERIVATIVES IN LABELLED AND UNLABELLED FORM NEUROSEARCH A/S (DK) 2001-01-17 EP claimed
EP-0984965-A1 8-AZABICYCLO(3,2,1)OCT-2-ENE AND OCTANE DERIVATIVES AS CHOLINERGIC LIGANDS AT NICOTINIC ACH RECEPTORS NEUROSEARCH A/S (DK) 2000-03-15 EP claimed
WO-1999038866-A1 8-AZABICYCLO[3.2.1]OCT-2-ENE DERIVATIVES IN LABELLED FORM AND USE OF 8-AZABICYCLO[3.2.1]OCT-2-ENE DERIVATIVES IN LABELLED AND UNLABELLED FORM NEUROSEARCH A/S (DK) 1999-08-05 WO claimed
WO-1998054181-A1 8-AZABICYCLO(3,2,1)OCT-2-ENE AND OCTANE DERIVATIVES AS CHOLINERGIC LIGANDS AT NICOTINIC ACH RECEPTORS NEUROSEARCH A/S (DK) 1998-12-03 WO claimed
EP-0859777-A1 8-AZABICYCLO 3.2.1]OCT-2-ENE DERIVATIVES, THEIR PREPARATION AND USE NEUROSEARCH A/S (DK) 1998-08-26 EP claimed
WO-1997013770-A1 8-AZABICYCLO[3.2.1]OCT-2-ENE DERIVATIVES, THEIR PREPARATION AND USE NEUROSEARCH A/S (DK) 1997-04-17 WO claimed
EP-2272847-A1 Enantiomers and their use as monoamine neurotransmitter re-uptake inhibitors NeuroSearch A/S (DK) 2011-01-12 EP disclosed
US-20090137625-A1 Novel Enantiomers and Their Use as Monoamine Neurotransmitter Re-Uptake Inhibitors NEUROSEARCH A/S (DK) 2009-05-28 US disclosed
EP-1869033-A1 NOVEL ENANTIOMERS AND THEIR USE AS MONOAMINE NEUROTRANSMITTER RE-UPTAKE INHIBITORS NEUROSEARCH A/S (DK) 2007-12-26 EP disclosed
EP-0859777-B1 8-AZABICYCLO(3.2.1)OCT-2-ENE DERIVATIVES, THEIR PREPARATION AND USE NEUROSEARCH AS (DK) 2007-05-23 EP disclosed
EP-1068204-A1 8-AZABICYCLO 3.2.1]OCT-2-ENE DERIVATIVES IN LABELLED AND USE OF 8-AZABICYCLO 3.2.1]OCT-2-ENE DERIVATIVES IN LABELLED AND UNLABELLED FORM NEUROSEARCH A/S (DK) 2001-01-17 EP disclosed
US-6100275-A SEROTONIN RE-UPTAKE INHIBITORS; ANTIDEPRESSANTS NEUROSEARCH A/S (DK) 2000-08-08 US disclosed
WO-1999038866-A1 8-AZABICYCLO[3.2.1]OCT-2-ENE DERIVATIVES IN LABELLED FORM AND USE OF 8-AZABICYCLO[3.2.1]OCT-2-ENE DERIVATIVES IN LABELLED AND UNLABELLED FORM NEUROSEARCH A/S (DK) 1999-08-05 WO disclosed
EP-0859777-A1 8-AZABICYCLO 3.2.1]OCT-2-ENE DERIVATIVES, THEIR PREPARATION AND USE NEUROSEARCH A/S (DK) 1998-08-26 EP disclosed
WO-1997013770-A1 8-AZABICYCLO[3.2.1]OCT-2-ENE DERIVATIVES, THEIR PREPARATION AND USE NEUROSEARCH A/S (DK) 1997-04-17 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-20090137625-A1 Novel Enantiomers and Their Use as Monoamine Neurotransmitter Re-Uptake Inhibitors SLC18A2, SLC6A2, SLC6A3 SLC6A4 5/4885SLC6A3 3/4885SLC6A2 2/4885

“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.