SCHEMBL1164584

SCHEMBL1164584

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nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CPT2 P23786 1/20 0.38
ACLY P53396 1/20 0.38
ALDH1A1 P00352 4/20 0.36
TSHR P16473 1/20 0.36
HSPD1 P10809 1/20 0.36
BLM P54132 1/20 0.36
HSPE1 P61604 1/20 0.36
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
HPGD P15428 1/20 0.33
RECQL P46063 1/20 0.33
HSD17B10 Q99714 1/20 0.33
CYP1A2 P05177 1/20 0.32
THRB P10828 1/20 0.32
FFAR3 O14843 1/20 0.32
CYP2C19 P33261 1/20 0.32
PIK3CD O00329 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
SCHEMBL19331402 1.00 CPT2 (0.38) CPT2ACLYALDH1A1TSHRHSPD1
SCHEMBL17008763 1.00 CPT2 (0.38) CPT2ACLYALDH1A1TSHRHSPD1
SCHEMBL14920851 0.85 HSPD1 (0.38) CPT2ACLYALDH1A1TSHRHSPD1
SCHEMBL10535133 0.82 CPT2 (0.41) CPT2ACLYALDH1A1TSHRHSPD1
SCHEMBL10535147 0.82 CPT2 (0.41) CPT2ACLYALDH1A1TSHRHSPD1
SCHEMBL260454 0.82 CPT2 (0.41) CPT2ACLYALDH1A1TSHRHSPD1
SCHEMBL20702119 0.80 CPT2 (0.35) CPT2ACLYALDH1A1TSHRHSPD1
SCHEMBL9148021 0.80 CPT2 (0.40) CPT2ACLYALDH1A1TSHRHSPD1
SCHEMBL9064316 0.79 CPT2 (0.38) CPT2ACLYALDH1A1TSHRHSPD1
SCHEMBL6911619 0.77 CPT2 (0.37) CPT2ACLYALDH1A1TSHRHSPD1

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-20150266814-A1 METHODS, COMPOUNDS, AND COMPOSITIONS FOR DELIVERING 1,3-PROPANEDISULFONIC ACID BELLUS HEALTH (INTERNATIONAL) LIMITED (CH) 2015-09-24 US disclosed
WO-2011017800-A1 METHODS, COMPOUNDS, AND COMPOSITIONS FOR DELIVERING 1,3-PROPAN ED ISULFONIC ACID BELLUS HEALTH (INTERNATIONAL) LIMITED (CH) 2011-02-17 WO 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-20150266814-A1 METHODS, COMPOUNDS, AND COMPOSITIONS FOR DELIVERING 1,3-PROPANEDISULFONIC ACID SGMS1, GSS, HPGDS CPT2 1096/4885ACLY 2255/4885ALDH1A1 174/4885

“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.