SCHEMBL15066355

SCHEMBL15066355

CCN1CCN(CCN(CC)CCN2CCN(CC)CC2)CC1

nearest known ligand 0.41

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 2/20 0.41
SLC6A3 Q01959 4/20 0.39
SLC6A4 P31645 2/20 0.39
DRD2 P14416 2/20 0.37
SLC6A2 P23975 1/20 0.36
RAD52 P43351 1/20 0.36

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
SCHEMBL15401669 0.95 SIGMAR1 (0.38) SIGMAR1SLC6A3SLC6A4DRD2RAD52
SCHEMBL15066275 0.93 SIGMAR1 (0.37) SIGMAR1SLC6A3SLC6A4DRD2RAD52
SCHEMBL13008040 0.88 SIGMAR1 (0.36) SIGMAR1SLC6A3SLC6A4DRD2SLC6A2
SCHEMBL19149177 0.85 SIGMAR1 (0.35) SIGMAR1SLC6A3SLC6A4DRD2SLC6A2
SCHEMBL13008047 0.84 SIGMAR1 (0.34) SIGMAR1SLC6A3SLC6A4DRD2SLC6A2
SCHEMBL13008048 0.82 ACE2 (0.52) SIGMAR1SLC6A3SLC6A4RAD52
SCHEMBL19071674 0.82 SIGMAR1 (0.33) SIGMAR1SLC6A3SLC6A4DRD2RAD52
SCHEMBL12677693 0.82 KDM1A (0.37)
SCHEMBL12156580 0.81 DRD2 (0.39) SIGMAR1SLC6A3SLC6A4DRD2SLC6A2
SCHEMBL1488103 0.81 SIGMAR1 (0.38) SIGMAR1SLC6A3SLC6A4DRD2RAD52

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-9644066-B2 Cyclic amine compounds, compositions, and polyurethane foams made therefrom DOW GLOBAL TECHNOLOGIES LLC (US) 2017-05-09 US disclosed
EP-2797902-B1 COMPOSITIONS CONTAINING CYCLIC AMINE COMPOUNDS, AND POLYURETHANE FOAMS MADE THEREFROM DOW GLOBAL TECHNOLOGIES LLC (US) 2017-04-26 EP disclosed
US-20150005404-A1 CYCLIC AMINE COMPOUNDS, COMPOSITIONS, AND POLYURETHANE FOAMS MADE THEREFROM DOW GLOBAL TECHNOLOGIES LLC 2015-01-01 US disclosed
EP-2797902-A2 CYCLIC AMINE COMPOUNDS, COMPOSITIONS, AND POLYURETHANE FOAMS MADE THEREFROM Dow Global Technologies LLC (US) 2014-11-05 EP disclosed
WO-2013102097-A2 CYCLIC AMINE COMPOUNDS, COMPOSITIONS, AND POLYURETHANE FOAMS MADE THEREFROM DOW GLOBAL TECHNOLOGIES LLC (US) 2013-07-04 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-20150005404-A1 CYCLIC AMINE COMPOUNDS, COMPOSITIONS, AND POLYURETHANE FOAMS MADE THEREFROM PUF60, UFM1, POLM SIGMAR1 2641/4885SLC6A3 3388/4885SLC6A4 4346/4885

“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.