SCHEMBL26699604

SCHEMBL26699604

CCC(C)N(CC(O)CO)CC(O)CO

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KCNA5 P22460 1/20 0.38
KCNJ5 P48544 1/20 0.38
KCNJ3 P48549 1/20 0.38
SCN5A Q14524 1/20 0.38
KCND3 Q9UK17 1/20 0.38
LMNA P02545 2/20 0.36
ALDH1A1 P00352 1/20 0.36
TSHR P16473 2/20 0.35
TDP1 Q9NUW8 1/20 0.35
SLC6A9 P48067 1/20 0.31
THRB P10828 1/20 0.31

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
SCHEMBL4147100 0.91 KCNA5 (0.36) KCNA5KCNJ5KCNJ3SCN5AKCND3
SCHEMBL25685120 0.79 ALDH1A1 (0.35) KCNA5KCNJ5KCNJ3SCN5AKCND3
SCHEMBL3975457 0.79 ALDH1A1 (0.35) KCNA5KCNJ5KCNJ3SCN5AKCND3
SCHEMBL24292469 0.77 KCNA5 (0.50) KCNA5KCNJ5KCNJ3SCN5AKCND3
SCHEMBL7776690 0.77 TSHR (0.47) KCNA5ALDH1A1TSHRTDP1
SCHEMBL20753133 0.77 LMNA (0.42) KCNA5KCNJ5KCNJ3SCN5AKCND3
SCHEMBL7571504 0.76 KCNA5 (0.38) KCNA5KCNJ5KCNJ3SCN5AKCND3
SCHEMBL25761576 0.76 KCNA5 (0.38) KCNA5KCNJ5KCNJ3SCN5AKCND3
SCHEMBL20465406 0.71 TSHR (0.41) KCNA5TSHR
SCHEMBL2478250 0.71 CYP1A2 (0.31) TSHR

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-20230338415-A1 SUBSTITUTED PHENYL BORONIC ACID CONTAINING POLYMERS AND METHODS OF USE GLYSCEND, INC. 2023-10-26 US disclosed
US-20230338415-A1 SUBSTITUTED PHENYL BORONIC ACID CONTAINING POLYMERS AND METHODS OF USE GLYSCEND, INC. 2023-10-26 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-20230338415-A1 SUBSTITUTED PHENYL BORONIC ACID CONTAINING POLYMERS AND METHODS OF USE SLC10A2, PYGL, SLC10A1 KCNA5 4734/4885KCNJ5 4767/4885KCNJ3 4727/4885

“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.