SCHEMBL1189971

SCHEMBL1189971

O=C(O)N1CC[C@H](NCc2ccccc2)C1

nearest known ligand 0.60

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ACHE P22303 10/20 0.60
BACE1 P56817 10/20 0.60
BCHE P06276 9/20 0.60
DRD4 P21917 1/20 0.57
TEAD1 P28347 2/20 0.52
LTA4H P09960 2/20 0.51
FABP6 P51161 1/20 0.49
NPSR1 Q6W5P4 1/20 0.49
CARM1 Q86X55 1/20 0.49
PRMT6 Q96LA8 1/20 0.49
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 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
SCHEMBL16269315 1.00 ACHE (0.60) ACHEBACE1BCHEDRD4TEAD1
SCHEMBL994595 0.91 ACHE (0.54) ACHEBACE1BCHEDRD4FABP6
SCHEMBL2241661 0.91 ACHE (0.54) ACHEBACE1BCHEDRD4FABP6
SCHEMBL377906 0.91 DRD4 (0.64) ACHEBACE1BCHEDRD4TEAD1
SCHEMBL1562904 0.90 ACHE (0.52) ACHEBACE1BCHEDRD4FABP6
SCHEMBL20766057 0.87 BCHE (0.59) ACHEBACE1BCHEDRD4TEAD1
SCHEMBL4080791 0.85 FABP6 (0.60) ACHEBACE1BCHEDRD4FABP6
SCHEMBL11889388 0.85 DRD4 (0.49) ACHEBACE1BCHEDRD4FABP6
SCHEMBL11889448 0.85 DRD4 (0.49) ACHEBACE1BCHEDRD4FABP6
SCHEMBL28885289 0.84 SMN1; SMN2 (0.60) ACHEBACE1BCHEDRD4NPSR1

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7893056-B2 Peptide deformylase inhibitors GLAXOSMITHKLINE LLC (US) 2011-02-22 US disclosed
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 ACHE 393/4885BACE1 2336/4885BCHE 1294/4885

“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.