SCHEMBL13701445

SCHEMBL13701445

CCN(CC)CCN1CCCC1

nearest known ligand 0.50

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 3/20 0.50
SLC6A3 Q01959 4/20 0.46
SLC6A4 P31645 2/20 0.46
DRD2 P14416 2/20 0.44
SLC6A2 P23975 1/20 0.43
HRH3 Q9Y5N1 5/20 0.41
CARM1 Q86X55 1/20 0.41
PRMT6 Q96LA8 1/20 0.41
PRMT8 Q9NR22 1/20 0.41

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
SCHEMBL4617835 0.98 SIGMAR1 (0.49) SIGMAR1SLC6A3SLC6A4DRD2SLC6A2
Hydrochloric Acid SCHEMBL11609607 0.95 SIGMAR1 (0.47) SIGMAR1SLC6A3SLC6A4DRD2SLC6A2
SCHEMBL11955738 0.95 SIGMAR1 (0.46) SIGMAR1SLC6A3SLC6A4DRD2SLC6A2
SCHEMBL12156673 0.86 HRH3 (0.48) SIGMAR1HRH3
SCHEMBL18379164 0.85 SIGMAR1 (0.48) SIGMAR1SLC6A3SLC6A4DRD2SLC6A2
SCHEMBL21243049 0.85 SIGMAR1 (0.41) SIGMAR1SLC6A3SLC6A4DRD2PRMT6
SCHEMBL11922753 0.84 HRH3 (0.52) HRH3
SCHEMBL10058642 0.84 HRH3 (0.48) SIGMAR1HRH3CARM1PRMT6PRMT8
SCHEMBL15401669 0.83 SIGMAR1 (0.38) SIGMAR1SLC6A3SLC6A4DRD2
SCHEMBL1488103 0.83 SIGMAR1 (0.38) SIGMAR1SLC6A3SLC6A4DRD2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090226411-A1 CHEMICAL DERIVATIVES AND THEIR APPLICATION AS ANTITELOMERASE AGENTS AVENTIS PHARMA S.A. (FR) 2009-09-10 US disclosed
US-7482352-B2 Chemical derivatives and their application as antitelomerase agents AVENTIS PHARMA S.A. (FR) 2009-01-27 US 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-20090226411-A1 CHEMICAL DERIVATIVES AND THEIR APPLICATION AS ANTITELOMERASE AGENTS DPYD, NTPCR, NME1 SIGMAR1 2658/4885SLC6A3 4497/4885SLC6A4 4685/4885

“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.