SCHEMBL15533293

SCHEMBL15533293

C=CCc1sccc1CC(=O)O

nearest known ligand 0.37

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.36
GAA P10253 1/20 0.36
LTB4R Q15722 6/20 0.36
AKR1B1 P15121 2/20 0.36
PTGDR2 Q9Y5Y4 3/20 0.34
PTGDR Q13258 1/20 0.34
KMT2A Q03164 2/20 0.33
MEN1 O00255 1/20 0.33
USP2 O75604 1/20 0.33
ALDH1A1 P00352 1/20 0.33
HPGD P15428 1/20 0.33
HSD17B10 Q99714 1/20 0.33
KEAP1 Q14145 1/20 0.33
NFE2L2 Q16236 1/20 0.33
TP53 P04637 1/20 0.33
ALOX15 P16050 1/20 0.33
MAPK1 P28482 1/20 0.33
SRC P12931 1/20 0.33
TDP1 Q9NUW8 1/20 0.33

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
SCHEMBL7556532 0.86 KDM4E (0.39) KDM4EGAALTB4RAKR1B1PTGDR2
SCHEMBL10424599 0.81 AKR1B1 (0.43) KDM4ELTB4RAKR1B1PTGDR2KMT2A
SCHEMBL1164626 0.79 GABRA1 (0.36)
SCHEMBL15532895 0.79 PKM (0.39) KDM4EGAAKMT2AMEN1HSD17B10
SCHEMBL15604516 0.77 ALDH1A1 (0.41) KDM4EGAAKMT2AMEN1ALDH1A1
SCHEMBL367774 0.77 AKR1B1 (0.39) LTB4RAKR1B1PTGDR2KMT2AALDH1A1
SCHEMBL11636866 0.77 KEAP1 (0.40) KDM4ELTB4RAKR1B1PTGDR2KMT2A
SCHEMBL3801503 0.75 KMT2A (0.40) KDM4EGAAKMT2AMEN1ALDH1A1
SCHEMBL10584739 0.75 ALOX5 (0.34) LTB4RPTGDR2PTGDRKMT2AMEN1
SCHEMBL11661785 0.72 LTB4R (0.36) GAALTB4RAKR1B1PTGDR2KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180134726-A1 PLANT GROWTH REGULATING COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2018-05-17 US disclosed
US-20180134726-A1 PLANT GROWTH REGULATING COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2018-05-17 US disclosed
US-20180134726-A1 PLANT GROWTH REGULATING COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2018-05-17 US disclosed
EP-2854541-B1 PLANT GROWTH REGULATING COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2016-06-15 EP disclosed
EP-2854541-B1 PLANT GROWTH REGULATING COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2016-06-15 EP disclosed
EP-2854541-A1 PLANT GROWTH REGULATING COMPOUNDS Syngenta Participations AG (CH) 2015-04-08 EP disclosed
WO-2013174846-A1 PLANT GROWTH REGULATING COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2013-11-28 WO disclosed
WO-2013174846-A1 PLANT GROWTH REGULATING COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2013-11-28 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-20180134726-A1 PLANT GROWTH REGULATING COMPOUNDS GHITM, GHDC, AREG KDM4E 3395/4885GAA 1203/4885LTB4R 3273/4885

“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.