SCHEMBL16660369

SCHEMBL16660369

CC1CN(CC(=O)O)CCN(CC(=O)O)C(C)CN(CC(=O)O)CCN1CC(=O)O

nearest known ligand 0.53

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SLC6A9 P48067 13/20 0.53
SIGMAR1 Q99720 1/20 0.48
HSD17B10 Q99714 1/20 0.38

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
SCHEMBL2290670 1.00 SLC6A9 (0.53) SLC6A9SIGMAR1HSD17B10
SCHEMBL1144711 0.98 SLC6A9 (0.51) SLC6A9SIGMAR1HSD17B10
SCHEMBL16800540 0.98 SLC6A9 (0.51) SLC6A9SIGMAR1HSD17B10
SCHEMBL9182778 0.98 SLC6A9 (0.51) SLC6A9SIGMAR1HSD17B10
SCHEMBL16660371 0.92 SLC6A9 (0.47) SLC6A9SIGMAR1HSD17B10
SCHEMBL16660370 0.92 SLC6A9 (0.47) SLC6A9SIGMAR1HSD17B10
SCHEMBL2799303 0.90 SLC6A9 (0.44) SLC6A9SIGMAR1HSD17B10
SCHEMBL20978841 0.90 SLC6A9 (0.44) SLC6A9SIGMAR1HSD17B10
SCHEMBL24709148 0.88 SLC6A9 (0.43) SLC6A9SIGMAR1HSD17B10
SCHEMBL18872988 0.87 SLC6A9 (0.44) SLC6A9SIGMAR1HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150110715-A1 Double-Labeled Probe for Molecular Imaging and Use Thereof RUPRECHT-KARLS-UNIVERSITAT HEIDELBERG (DE) 2015-04-23 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-20150110715-A1 Double-Labeled Probe for Molecular Imaging and Use Thereof CD47, ANXA5, CD44 SLC6A9 373/4885SIGMAR1 1278/4885HSD17B10 4215/4885

“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.