SCHEMBL407914

SCHEMBL407914

O=C1CC(=O)[C@H]2[C@@H]1[C@@H]1CC[C@H]2O1

nearest known ligand 0.56

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PPM1B O75688 2/20 0.56
KDM4E B2RXH2 2/20 0.56
GMNN O75496 2/20 0.56
LMNA P02545 2/20 0.56
TFPI2 P48307 2/20 0.56
PMP22 Q01453 2/20 0.56
TP53 P04637 2/20 0.56
NFKB1 P19838 2/20 0.56
THPO P40225 2/20 0.56
SMN1; SMN2 Q16637 2/20 0.56
PPP1CC P36873 1/20 0.56
RAB9A P51151 1/20 0.56
PPP5C P53041 1/20 0.56
PPP1CA P62136 1/20 0.56
TDP1 Q9NUW8 1/20 0.56
CYP2D6 P10635 1/20 0.56
L3MBTL1 Q9Y468 1/20 0.36
TSHR P16473 1/20 0.35

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
SCHEMBL2120400 1.00 PPM1B (0.56) PPM1BKDM4EGMNNLMNATFPI2
SCHEMBL18873967 1.00 PPM1B (0.56) PPM1BKDM4EGMNNLMNATFPI2
SCHEMBL13556829 1.00 PPM1B (0.56) PPM1BKDM4EGMNNLMNATFPI2
SCHEMBL14381277 0.72 TP53 (0.56) PPM1BKDM4EGMNNLMNATFPI2
Demethyl-Cantharidin SCHEMBL19318920 0.72 TP53 (1.00) PPM1BKDM4EGMNNLMNATFPI2
Demethyl-Cantharidin SCHEMBL9675442 0.72 TP53 (1.00) PPM1BKDM4EGMNNLMNATFPI2
Demethyl-Cantharidin SCHEMBL3195020 0.72 TP53 (1.00) PPM1BKDM4EGMNNLMNATFPI2
SCHEMBL17773447 0.72 TP53 (0.56) PPM1BKDM4EGMNNLMNATFPI2
SCHEMBL2548229 0.72 TP53 (0.56) PPM1BKDM4EGMNNLMNATFPI2
Demethyl-Cantharidin SCHEMBL177729 0.72 TP53 (1.00) PPM1BKDM4EGMNNLMNATFPI2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2389066-B1 CYCLOPENTADIONE DERIVED HERBICIDES SYNGENTA LTD (GB) 2017-07-05 EP disclosed
EP-2389066-B1 CYCLOPENTADIONE DERIVED HERBICIDES SYNGENTA LTD (GB) 2017-07-05 EP disclosed
EP-2173755-B1 NOVEL HERBICIDES SYNGENTA LTD (GB) 2017-05-17 EP disclosed
US-8940913-B2 Herbicides SYNGENTA CROP PROTECTION, LLC (US) 2015-01-27 US disclosed
US-8940913-B2 Herbicides SYNGENTA CROP PROTECTION, LLC (US) 2015-01-27 US disclosed
US-8895474-B2 Herbicidally active cyclopentanediones and derivatives thereof, and their use in controlling weeds SYNGENTA LIMITED (GB) 2014-11-25 US disclosed
US-8895474-B2 Herbicidally active cyclopentanediones and derivatives thereof, and their use in controlling weeds SYNGENTA LIMITED (GB) 2014-11-25 US disclosed
US-8895474-B2 Herbicidally active cyclopentanediones and derivatives thereof, and their use in controlling weeds SYNGENTA LIMITED (GB) 2014-11-25 US disclosed
EP-2185564-B1 Herbicidally active cyclopentanedione compounds and derivatives thereof SYNGENTA LTD (GB) 2014-06-18 EP disclosed
US-8754242-B2 Herbicides SYNGENTA CROP PROTECTION LLC (US) 2014-06-17 US disclosed
US-8754242-B2 Herbicides SYNGENTA CROP PROTECTION LLC (US) 2014-06-17 US disclosed
US-20120142529-A1 NOVEL HERBICIDES SYNGENTA CROP PROTECTION, INC. (US) 2012-06-07 US disclosed
US-20120142529-A1 NOVEL HERBICIDES SYNGENTA CROP PROTECTION, INC. (US) 2012-06-07 US disclosed
US-20120094832-A1 NOVEL HERBICIDES SYNGENTA LIMITED (GB) 2012-04-19 US disclosed
US-20120094832-A1 NOVEL HERBICIDES SYNGENTA LIMITED (GB) 2012-04-19 US disclosed
US-20120021912-A1 NOVEL HERBICIDES SYNGENTA CROP PROTECTION LLC (US) 2012-01-26 US disclosed
US-20120021912-A1 NOVEL HERBICIDES SYNGENTA CROP PROTECTION LLC (US) 2012-01-26 US disclosed
US-20120021912-A1 NOVEL HERBICIDES SYNGENTA CROP PROTECTION LLC (US) 2012-01-26 US disclosed
WO-2010102848-A1 CYCLOPENTADIONE DERIVED HERBICIDES SYNGENTA LIMITED (GB) 2010-09-16 WO disclosed
WO-2009019005-A2 NOVEL HERBICIDES SYNGENTA LIMITED (GB) 2009-02-12 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 (3 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-20120021912-A1 NOVEL HERBICIDES DDT, CYP4X1, CYP1B1 PPM1B 313/4885KDM4E 1092/4885GMNN 1351/4885
US-20120142529-A1 NOVEL HERBICIDES DDT, CYP4X1, CYP1B1 PPM1B 313/4885KDM4E 1092/4885GMNN 1351/4885
US-20120094832-A1 NOVEL HERBICIDES DDT, CYP1B1, CYP1A1 PPM1B 323/4885KDM4E 1070/4885GMNN 1348/4885

“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.