SCHEMBL30846993

SCHEMBL30846993

CC(=O)CCCCCCS(C)(=O)=O

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PAOX Q6QHF9 6/20 0.50
ALDH1A1 P00352 3/20 0.41
ACHE P22303 1/20 0.39
LMNA P02545 4/20 0.38
TP53 P04637 1/20 0.38
SLC15A2 Q16348 1/20 0.35
MEN1 O00255 1/20 0.32
GAA P10253 1/20 0.32
HTT P42858 1/20 0.32
KMT2A Q03164 1/20 0.32
CES2 O00748 3/20 0.32
CES1 P23141 3/20 0.32
TSHR P16473 1/20 0.32
NFKB1 P19838 1/20 0.32
PMP22 Q01453 1/20 0.32
PLA2G2C Q5R387 1/20 0.32

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
SCHEMBL16656477 0.90 ALDH1A1 (0.45) PAOXALDH1A1ACHELMNATP53
SCHEMBL15259285 0.81 PAOX (0.50) PAOXALDH1A1ACHELMNASLC15A2
SCHEMBL11456167 0.81 SOAT1 (0.42) PAOXALDH1A1LMNATP53MEN1
SCHEMBL4004597 0.81 TSHR (0.57) ALDH1A1LMNAMEN1KMT2ATSHR
SCHEMBL9340855 0.81 TSHR (0.57) ALDH1A1LMNAMEN1KMT2ATSHR
SCHEMBL2567545 0.81 TSHR (0.57) ALDH1A1LMNAMEN1KMT2ATSHR
SCHEMBL7765920 0.81 SOAT1 (0.42) PAOXALDH1A1LMNATP53MEN1
SCHEMBL2810385 0.81 SOAT1 (0.42) PAOXALDH1A1LMNATP53MEN1
SCHEMBL21616868 0.81 TSHR (0.57) ALDH1A1LMNAMEN1KMT2ATSHR
SCHEMBL29398161 0.81 PAOX (0.50) PAOXALDH1A1ACHELMNASLC15A2

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-11963527-B2 Compounds, compositions, and methods for altering insect and organism behavior BASF CORPORATION (US) 2024-04-23 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-11963527-B2 Compounds, compositions, and methods for altering insect and organism behavior ACHE, DDT, MGLL PAOX 412/4885ALDH1A1 3218/4885ACHE 1/4885

“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.