SCHEMBL4479507

SCHEMBL4479507

O=C(O)N1CC[C@H](N(Cc2ccccc2C(F)(F)F)CC2CCOC2)C1

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 12/20 0.48
SLC6A4 P31645 12/20 0.48
CYP2D6 P10635 7/20 0.41
CYP2C9 P11712 7/20 0.41
PGR P06401 6/20 0.41
SLC6A3 Q01959 2/20 0.39
KCNH2 Q12809 1/20 0.39
KDM4E B2RXH2 1/20 0.38
CYP2C19 P33261 1/20 0.38
HTR2B P41595 1/20 0.38
MAPK14 Q16539 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
SCHEMBL5440605 0.94 SLC6A2 (0.47) SLC6A2SLC6A4CYP2D6SLC6A3KCNH2
SCHEMBL4687364 0.87 PGR (0.43) SLC6A2SLC6A4CYP2D6CYP2C9PGR
SCHEMBL4491414 0.83 CYP2D6 (0.50) SLC6A2SLC6A4CYP2D6CYP2C9PGR
SCHEMBL4491408 0.83 CYP2D6 (0.50) SLC6A2SLC6A4CYP2D6CYP2C9PGR
SCHEMBL4485140 0.83 CYP2D6 (0.50) SLC6A2SLC6A4CYP2D6CYP2C9PGR
SCHEMBL4485135 0.83 CYP2D6 (0.50) SLC6A2SLC6A4CYP2D6CYP2C9PGR
SCHEMBL5112323 0.82 SLC6A2 (0.41) SLC6A2SLC6A4CYP2D6CYP2C9PGR
SCHEMBL4497702 0.80 SLC6A2 (0.60) SLC6A2SLC6A4CYP2D6CYP2C9PGR
SCHEMBL4687367 0.79 SLC6A2 (0.43) SLC6A2SLC6A4CYP2D6SLC6A3KCNH2
SCHEMBL5112330 0.78 SLC6A2 (0.42) SLC6A2SLC6A4SLC6A3KDM4E

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 4 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
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 SLC6A2 1/4885SLC6A4 5/4885CYP2D6 97/4885

“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.