SCHEMBL11962337

SCHEMBL11962337

CCC(C)C(=O)C(O)C1CCCCN1

nearest known ligand 0.50

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 13/20 0.42
SLC6A3 Q01959 13/20 0.42
SLC6A4 P31645 12/20 0.42
FDPS P14324 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
SCHEMBL9611658 0.90 PRCP (0.33) SLC6A2SLC6A3SLC6A4
SCHEMBL6914280 0.83 SLC6A3 (0.43) SLC6A2SLC6A3SLC6A4
SCHEMBL19034906 0.78 SLC6A3 (0.43) SLC6A2SLC6A3SLC6A4
SCHEMBL6913506 0.78 SLC6A3 (0.37) SLC6A2SLC6A3SLC6A4
SCHEMBL9284514 0.75 SLC6A3 (0.53) SLC6A2SLC6A3SLC6A4
SCHEMBL1225118 0.73 SLC6A2 (0.46) SLC6A2SLC6A3SLC6A4
SCHEMBL13510425 0.73 SLC6A2 (0.46) SLC6A2SLC6A3SLC6A4
SCHEMBL1225120 0.73 SLC6A2 (0.46) SLC6A2SLC6A3SLC6A4
SCHEMBL3478050 0.73 SLC6A2 (0.46) SLC6A2SLC6A3SLC6A4
SCHEMBL1932043 0.73 SLC6A2 (0.46) SLC6A2SLC6A3SLC6A4

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-20120196791-A1 COMBINATION THERAPIES USING ANTIBACTERIAL AMINOGLYCOSIDE COMPOUNDS ACHAOGEN, INC. (US) 2012-08-02 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-20120196791-A1 COMBINATION THERAPIES USING ANTIBACTERIAL AMINOGLYCOSIDE COMPOUNDS PIGS, PIGO, NPEPPS SLC6A2 2636/4885SLC6A3 3072/4885SLC6A4 3733/4885

“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.