SCHEMBL13970169

SCHEMBL13970169

CC1CCC(C)([C@@H](NC(=O)OC(C)(C)C)c2ccccc2)N(C)C1

nearest known ligand 0.40

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SLC6A9 P48067 13/20 0.40
SLC6A5 Q9Y345 1/20 0.39
CTSK P43235 3/20 0.39
CTSS P25774 1/20 0.39
SCN9A Q15858 1/20 0.37
CCR5 P51681 1/20 0.37
ATM Q13315 1/20 0.37

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
SCHEMBL8080629 1.00 SLC6A9 (0.40) SLC6A9SLC6A5CTSKCTSSSCN9A
SCHEMBL13970253 1.00 SLC6A9 (0.40) SLC6A9SLC6A5CTSKCTSSSCN9A
SCHEMBL8080724 0.83 MAPT (0.42) CTSKCTSSCCR5ATM
SCHEMBL7896421 0.78 SLC6A9 (0.64) SLC6A9SLC6A5
SCHEMBL7894745 0.78 SLC6A9 (0.64) SLC6A9SLC6A5
SCHEMBL7899345 0.78 SLC6A9 (0.64) SLC6A9SLC6A5
SCHEMBL8086589 0.78 SLC6A9 (0.52) SLC6A9SLC6A5
SCHEMBL13970248 0.78 SLC6A9 (0.53) SLC6A9SLC6A5
SCHEMBL8091798 0.78 SLC6A9 (0.57) SLC6A9
SCHEMBL2605333 0.76 SLC6A9 (0.62) SLC6A9SLC6A5CTSKCTSS

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-20090030033-A1 Novel Compounds 894 ASTRAZENECA AB (SE) 2009-01-29 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-20090030033-A1 Novel Compounds 894 AZI2, TPMT, AMPD2 SLC6A9 4382/4885SLC6A5 3965/4885CTSK 1676/4885

“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.