SCHEMBL19984887

SCHEMBL19984887

CNC(=O)/C(=C/O)C1CCc2ccccc21

nearest known ligand 0.50

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PIN1 Q13526 4/20 0.47
PDPK1 O15530 1/20 0.44
KCNQ2 O43526 1/20 0.41
ANO1 Q5XXA6 2/20 0.39
CYP2D6 P10635 4/20 0.39
SLC6A2 P23975 4/20 0.39
SLC6A4 P31645 4/20 0.39
SLC6A3 Q01959 4/20 0.39
CYP2C9 P11712 1/20 0.39
TAS1R3 Q7RTX0 3/20 0.38
TAS1R1 Q7RTX1 3/20 0.38
TAS1R2 Q8TE23 3/20 0.38

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
SCHEMBL21538767 0.83 PIN1 (0.52) PIN1PDPK1KCNQ2ANO1TAS1R3
SCHEMBL10469672 0.79 PIN1 (0.54) PIN1PDPK1KCNQ2ANO1TAS1R3
SCHEMBL23934292 0.78 PIN1 (0.40) PIN1PDPK1KCNQ2ANO1
SCHEMBL19984933 0.77 PIN1 (0.40) PIN1PDPK1KCNQ2ANO1
SCHEMBL19985038 0.77 PIN1 (0.46) PIN1KCNQ2ANO1
SCHEMBL19984882 0.77 PIN1 (0.46) PIN1PDPK1KCNQ2ANO1TAS1R3
SCHEMBL19984921 0.75 NFE2L2 (0.39) PIN1PDPK1KCNQ2TAS1R3TAS1R1
SCHEMBL19984930 0.75 NFE2L2 (0.39) PIN1PDPK1KCNQ2TAS1R3TAS1R1
SCHEMBL8848989 0.73 PIN1 (0.58) PIN1PDPK1KCNQ2ANO1TAS1R3
SCHEMBL4742598 0.73 PIN1 (0.58) PIN1PDPK1KCNQ2ANO1TAS1R3

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 2117/4885PDPK1 1125/4885KCNQ2 4502/4885
US-20190330148-A1 PLANT GROWTH REGULATOR COMPOUNDS FGF1, MST1, CDC20 PIN1 2117/4885PDPK1 1125/4885KCNQ2 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.