SCHEMBL3661796

SCHEMBL3661796

COC(=O)CN1CCC(C(c2ccccc2)c2cccc(C)c2)C1

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 1/20 0.44
SLC6A9 P48067 1/20 0.43
CCR5 P51681 2/20 0.43
DRD2 P14416 1/20 0.42
DRD4 P21917 1/20 0.42
DRD3 P35462 1/20 0.42
CCR8 P51685 1/20 0.42
CHRM3 P20309 2/20 0.41
HTT P42858 1/20 0.40
NPY2R P49146 1/20 0.40
MGLL Q99685 1/20 0.40

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
SCHEMBL3661405 0.89 SLC6A9 (0.52) BACE1SLC6A9CCR5DRD2DRD4
SCHEMBL7359674 0.77 ALDH1A1 (0.55) BACE1NPY2R
SCHEMBL3664387 0.77 BACE1 (0.53) BACE1SLC6A9CCR5
SCHEMBL14282927 0.75 BACE1 (0.52) BACE1NPY2R
SCHEMBL4253158 0.74 PRCP (0.55) BACE1NPY2R
SCHEMBL9908745 0.71 HRH1 (0.40) BACE1DRD2DRD4DRD3
SCHEMBL14232131 0.71 BACE1 (0.48) BACE1
SCHEMBL3658957 0.70 ALDH1A1 (0.47) CCR5
SCHEMBL3661510 0.70 BACE1 (0.48) BACE1
SCHEMBL3662230 0.69 BACE1 (0.58) BACE1

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-8258306-B2 Glycine transporter-1 inhibitors AMGEN INC. (US) 2012-09-04 US disclosed
US-20100298341-A1 Glycine Transporter-1 Inhibitors AMGEN INC. 2010-11-25 US disclosed
EP-2231601-A2 GLYCINE TRANSPORTER-1 INHIBITORS Amgen, Inc (US) 2010-09-29 EP disclosed
WO-2009075857-A2 GLYCINE TRANSPORTER-1 INHIBITORS AMGEN INC. (US) 2009-06-18 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-20100298341-A1 Glycine Transporter-1 Inhibitors SLC18A2, SLC7A11, SLC6A5 BACE1 201/4885SLC6A9 8/4885CCR5 2040/4885

“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.