SCHEMBL19984886

SCHEMBL19984886

CN(C)/C=C(/C(=O)N(C)C(=O)OC(C)(C)C)C1CCc2ccccc21

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PIN1 Q13526 4/20 0.41
ANO1 Q5XXA6 2/20 0.36
KCNQ2 O43526 1/20 0.35
PPIB P23284 1/20 0.34
PPIA P62937 1/20 0.34
PTGDR2 Q9Y5Y4 1/20 0.34
ALDH1A1 P00352 1/20 0.33
XBP1 P17861 1/20 0.33
HTT P42858 1/20 0.33
MAPK1 P28482 1/20 0.33
MAPK14 Q16539 1/20 0.33
TAS1R3 Q7RTX0 1/20 0.32
TAS1R1 Q7RTX1 1/20 0.32
TAS1R2 Q8TE23 1/20 0.32
RAB9A P51151 1/20 0.32
SIGMAR1 Q99720 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
SCHEMBL19984882 0.76 PIN1 (0.46) PIN1ANO1KCNQ2PPIBPPIA
SCHEMBL19985042 0.73 MTNR1A (0.42) PIN1ALDH1A1XBP1HTT
SCHEMBL29496189 0.73 ALDH1A1 (0.50) PIN1ALDH1A1XBP1HTTRAB9A
SCHEMBL191810 0.73 ALDH1A1 (0.50) PIN1ALDH1A1XBP1HTTRAB9A
SCHEMBL19960654 0.73 ALDH1A1 (0.50) PIN1ALDH1A1XBP1HTTRAB9A
SCHEMBL28125950 0.68 PIN1 (0.45) PIN1ANO1KCNQ2PPIBPPIA
SCHEMBL21538767 0.66 PIN1 (0.52) PIN1ANO1KCNQ2PPIBPPIA
SCHEMBL23005712 0.66 HTR2C (0.39) ALDH1A1XBP1HTTMAPK1MAPK14
SCHEMBL16559324 0.66 HTR2C (0.39) ALDH1A1XBP1HTTMAPK1MAPK14
SCHEMBL3938891 0.66 MAOA (0.40) ALDH1A1XBP1HTTMAPK1MAPK14

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 2117/4885ANO1 3784/4885KCNQ2 4502/4885
US-20190330148-A1 PLANT GROWTH REGULATOR COMPOUNDS FGF1, MST1, CDC20 PIN1 2117/4885ANO1 3784/4885KCNQ2 4502/4885

“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.