SCHEMBL10196044

SCHEMBL10196044

O=C1CCC(O)=C1c1cc(Oc2ccc(Cl)cc2)ccc1C1CC1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 2/20 0.39
MAOB P27338 2/20 0.39
MEN1 O00255 1/20 0.36
POLB P06746 1/20 0.36
MAPK1 P28482 1/20 0.36
KMT2A Q03164 1/20 0.36
ALDH1A1 P00352 1/20 0.35
LMNA P02545 1/20 0.35
S1PR5 Q9H228 1/20 0.34
ADAMTS5 Q9UNA0 1/20 0.34
FFAR4 Q5NUL3 1/20 0.34
MMP2 P08253 2/20 0.33
MMP9 P14780 2/20 0.33
MGLL Q99685 1/20 0.33
DRD2 P14416 1/20 0.33
ELANE P08246 1/20 0.33
PDE4A P27815 1/20 0.32
PDE4B Q07343 1/20 0.32
PDE4C Q08493 1/20 0.32
PDE4D Q08499 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
SCHEMBL16256572 0.82 CYP1A2 (0.40) LMNAMAPTPTGDR2
SCHEMBL19070665 0.81 MAOA (0.41) MAOAMAOBMEN1POLBMAPK1
SCHEMBL10196155 0.79 MAOA (0.39) MAOAMAOBMEN1POLBMAPK1
SCHEMBL19070830 0.77 PBRM1 (0.45) MAOAMAOBMAPK1LMNA
SCHEMBL12119015 0.77 EDNRB (0.42) MGLL
SCHEMBL516287 0.77 MAOB (0.36) MAOAMAOBMEN1POLBMAPK1
SCHEMBL10196096 0.76 PNLIP (0.39) MAOAMAOBMEN1POLBMAPK1
SCHEMBL10195606 0.75 MAOB (0.37) MAOAMAOBMEN1POLBMAPK1
SCHEMBL10196066 0.75 EDNRB (0.37) MAPK1PTGDR2
SCHEMBL10195108 0.72 MAOA (0.41) MAOAMAOBMEN1POLBMAPK1

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 6 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
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-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

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-20120021912-A1 NOVEL HERBICIDES DDT, CYP4X1, CYP1B1 MAOA 2359/4885MAOB 2064/4885MEN1 4280/4885

“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.