SCHEMBL4489893

SCHEMBL4489893

Cc1cccc(CN(CC(C)C)[C@@H]2CCNC2)c1Cl

nearest known ligand 0.66

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 19/20 0.66
SLC6A2 P23975 19/20 0.66
SLC6A3 Q01959 11/20 0.66
CYP2D6 P10635 3/20 0.60
CYP3A4 P08684 1/20 0.52
KCNH2 Q12809 1/20 0.52

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
SCHEMBL4486554 1.00 SLC6A4 (0.66) SLC6A4SLC6A2SLC6A3CYP2D6CYP3A4
SCHEMBL5993281 0.93 SLC6A2 (0.77) SLC6A4SLC6A2SLC6A3
Cadaverine Tartrate SCHEMBL4490344 0.92 SLC6A4 (0.58) SLC6A4SLC6A2SLC6A3CYP2D6CYP3A4
Cadaverine Tartrate SCHEMBL4480383 0.92 SLC6A4 (0.58) SLC6A4SLC6A2SLC6A3CYP2D6CYP3A4
SCHEMBL4486621 0.89 SLC6A4 (0.70) SLC6A4SLC6A2SLC6A3CYP2D6CYP3A4
SCHEMBL4488505 0.88 SLC6A2 (0.85) SLC6A4SLC6A2SLC6A3CYP2D6KCNH2
SCHEMBL4488410 0.86 SLC6A2 (0.68) SLC6A4SLC6A2SLC6A3CYP2D6CYP3A4
SCHEMBL4486460 0.85 SLC6A2 (0.87) SLC6A4SLC6A2SLC6A3CYP2D6KCNH2
SCHEMBL4491709 0.85 SLC6A2 (0.87) SLC6A4SLC6A2SLC6A3CYP2D6KCNH2
SCHEMBL4489204 0.84 SLC6A2 (0.85) SLC6A4SLC6A2SLC6A3CYP2D6

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
US-7619096-B2 3-Aminopyrrolidines as inhibitors of monoamine uptake ELI LILLY AND COMPANY (US) 2009-11-17 US disclosed
EP-1638934-B1 3-AMINOPYRROLIDINES AS INHIBITORS OF MONOAMINE UPTAKE LILLY CO ELI (US) 2008-01-09 EP disclosed
US-20060270713-A1 3-Aminopyrrolidines as inhibitors of monoamine uptake ELI LILLY AND COMPANY 2006-11-30 US disclosed
EP-1638934-A1 3-AMINOPYRROLIDINES AS INHIBITORS OF MONOAMINE UPTAKE ELI LILLY AND COMPANY (US) 2006-03-29 EP disclosed
WO-2005000811-A1 3-AMINOPYRROLIDINES AS INHIBITORS OF MONOAMINE UPTAKE ELI LILLY AND COMPANY (US) 2005-01-06 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-20060270713-A1 3-Aminopyrrolidines as inhibitors of monoamine uptake SLC6A2, SLC6A3, SLC18A2 SLC6A4 5/4885SLC6A2 1/4885SLC6A3 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.