SCHEMBL19984925

SCHEMBL19984925

COC(=O)/C(=C/OC1OC(=O)C(C)=C1C)C1CCc2ccccc21

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PIN1 Q13526 7/20 0.41
PPIB P23284 1/20 0.34
PPIA P62937 1/20 0.34
ANO1 Q5XXA6 3/20 0.34
ROCK1 Q13464 1/20 0.34
ALDH1A1 P00352 2/20 0.33
HSD17B10 Q99714 1/20 0.33
ESR1 P03372 1/20 0.33
PGR P06401 1/20 0.33
NR3C2 P08235 1/20 0.33
AR P10275 1/20 0.33
ESR2 Q92731 1/20 0.33
KCNQ2 O43526 1/20 0.33
PDE4A P27815 1/20 0.33
PDE4B Q07343 1/20 0.33
PDE4C Q08493 1/20 0.33
PDE4D Q08499 1/20 0.33
PTGDR2 Q9Y5Y4 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
SCHEMBL19984922 0.90 PIN1 (0.37) PIN1ANO1ROCK1ALDH1A1
SCHEMBL23877356 0.89 PIN1 (0.40) PIN1PPIBPPIAANO1ROCK1
SCHEMBL21538743 0.89 PIN1 (0.36) PIN1PPIBPPIAANO1ROCK1
SCHEMBL21538720 0.84 ANO1 (0.37) ANO1ALDH1A1HSD17B10
SCHEMBL19985043 0.84 HPGD (0.36) ANO1ALDH1A1HSD17B10
SCHEMBL23877353 0.83 ALDH1A1 (0.38) ALDH1A1HSD17B10
SCHEMBL19984924 0.81 PIN1 (0.41) PIN1PPIBPPIAROCK1KCNQ2
SCHEMBL23877354 0.78 ANO1 (0.36) ANO1ESR1ESR2
SCHEMBL19984931 0.77 KMT2A (0.36) ALDH1A1
SCHEMBL19984936 0.77 KDM4E (0.34) ALDH1A1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3512843-B1 PLANT GROWTH REGULATOR COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2021-10-20 EP disclosed
US-11136292-B2 Plant growth regulator compounds SYNGENTA PARTICIPATIONS AG (CH) 2021-10-05 US disclosed
US-20190330148-A1 PLANT GROWTH REGULATOR COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2019-10-31 US disclosed
WO-2018050477-A1 PLANT GROWTH REGULATOR COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2018-03-22 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 (2 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-11136292-B2 Plant growth regulator compounds FGF1, MST1, CDC20 PIN1 2117/4885PPIB 2189/4885PPIA 3038/4885
US-20190330148-A1 PLANT GROWTH REGULATOR COMPOUNDS FGF1, MST1, CDC20 PIN1 2117/4885PPIB 2189/4885PPIA 3038/4885

“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.