SCHEMBL4495211

SCHEMBL4495211

CC(C)N(Cc1cccc(C(F)(F)F)c1)[C@H]1CCNC1

nearest known ligand 0.65

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 13/20 0.65
SLC6A2 P23975 13/20 0.65
TACR1 P25103 2/20 0.47
SLC6A3 Q01959 6/20 0.46
HTR2C P28335 2/20 0.46
HTR2A P28223 1/20 0.46
HTR2B P41595 1/20 0.46
DCUN1D1 Q96GG9 1/20 0.45

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
Fumaric Acid SCHEMBL4493084 0.90 SLC6A2 (0.71) SLC6A4SLC6A2TACR1SLC6A3DCUN1D1
Fumaric Acid SCHEMBL4493089 0.90 SLC6A2 (0.71) SLC6A4SLC6A2TACR1SLC6A3DCUN1D1
SCHEMBL5815530 0.86 SLC6A4 (0.61) SLC6A4SLC6A2TACR1SLC6A3
SCHEMBL4486778 0.86 SLC6A4 (0.61) SLC6A4SLC6A2TACR1SLC6A3
SCHEMBL4484165 0.82 SLC6A2 (0.52) SLC6A4SLC6A2TACR1SLC6A3
SCHEMBL5760877 0.81 SLC6A2 (0.63) SLC6A4SLC6A2TACR1SLC6A3HTR2C
SCHEMBL4486743 0.80 EED (0.52) SLC6A4SLC6A2SLC6A3HTR2C
SCHEMBL5821154 0.80 SLC6A4 (0.56) SLC6A4SLC6A2TACR1SLC6A3HTR2C
SCHEMBL4485877 0.80 SLC6A4 (0.56) SLC6A4SLC6A2TACR1SLC6A3HTR2C
SCHEMBL4483156 0.79 SLC6A4 (0.71) SLC6A4SLC6A2SLC6A3HTR2A

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 1/4885TACR1 138/4885

“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.