SCHEMBL1021480

SCHEMBL1021480

CN1C2C=C(c3ccc4ccccc4c3)CC1CC2

nearest known ligand 0.68

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SLC6A3 Q01959 6/20 0.68
SLC6A4 P31645 6/20 0.68
SLC6A2 P23975 4/20 0.68
HTR1A P08908 2/20 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
SCHEMBL1021477 1.00 SLC6A3 (0.68) SLC6A3SLC6A4SLC6A2HTR1A
SCHEMBL7210045 0.92 SLC6A3 (0.58) SLC6A3SLC6A4SLC6A2HTR1A
Trifluoroacetic Acid SCHEMBL8108321 0.88 SLC6A4 (0.58) SLC6A3SLC6A4SLC6A2HTR1A
SCHEMBL5829872 0.86 SLC6A2 (0.58) SLC6A3SLC6A4SLC6A2HTR1A
SCHEMBL5829875 0.86 SLC6A2 (0.58) SLC6A3SLC6A4SLC6A2HTR1A
SCHEMBL6553385 0.86 SLC6A4 (0.58) SLC6A3SLC6A4SLC6A2HTR1A
SCHEMBL5829523 0.86 SLC6A4 (0.58) SLC6A3SLC6A4SLC6A2HTR1A
SCHEMBL5830039 0.86 SLC6A4 (0.58) SLC6A3SLC6A4SLC6A2HTR1A
SCHEMBL5829782 0.86 SLC6A4 (0.58) SLC6A3SLC6A4SLC6A2HTR1A
SCHEMBL5829646 0.86 SLC6A4 (0.58) SLC6A3SLC6A4SLC6A2HTR1A

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-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
WO-2006108789-A1 NOVEL ENANTIOMERS AND THEIR USE AS MONOAMINE NEUROTRANSMITTER RE-UPTAKE INHIBITORS NEUROSEARCH A/S (DK) 2006-10-19 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
WO-2006108789-A1 NOVEL ENANTIOMERS AND THEIR USE AS MONOAMINE NEUROTRANSMITTER RE-UPTAKE INHIBITORS NEUROSEARCH A/S (DK) 2006-10-19 WO disclosed
US-6107307-A PSYCHOLOGICAL DISORDERS ELI LILLY AND COMPANY (US) 2000-08-22 US disclosed
EP-0969005-A1 Azabicyclic inhibitors of serotonin reuptake ELI LILLY AND COMPANY (US) 2000-01-05 EP 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 SLC6A3 3/4885SLC6A4 5/4885SLC6A2 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.