SCHEMBL10195457

SCHEMBL10195457

CCc1ccc(Oc2ccc3cc(Cl)ccc3n2)cc1C1=C(O)CC(C)(C)CC1=O

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.36
SMN1; SMN2 Q16637 4/20 0.36
MAPT P10636 3/20 0.36
KDM4E B2RXH2 2/20 0.36
TDP1 Q9NUW8 2/20 0.36
GAA P10253 2/20 0.36
RAB9A P51151 1/20 0.36
PDE4B Q07343 3/20 0.35
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
LMNA P02545 2/20 0.33
TP53 P04637 1/20 0.33
PDE1A P54750 1/20 0.33
PDE1B Q01064 1/20 0.33
PDE7A Q13946 1/20 0.33
SCN9A Q15858 4/20 0.32
IDH1 O75874 3/20 0.32
TSHR P16473 1/20 0.32
CASP1 P29466 1/20 0.32
CASP7 P55210 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
SCHEMBL10195499 0.88 SMN1; SMN2 (0.40) ALDH1A1SMN1; SMN2MAPTKDM4ETDP1
SCHEMBL10195186 0.88 ALDH1A1 (0.40) ALDH1A1SMN1; SMN2MAPTKDM4ETDP1
SCHEMBL10196170 0.87 PDE4B (0.34) ALDH1A1SMN1; SMN2MAPTPDE4BLMNA
SCHEMBL10195324 0.86 SCN9A (0.35) PDE4BPDE1APDE1BPDE7ASCN9A
SCHEMBL10195510 0.85 SMN1; SMN2 (0.37) ALDH1A1SMN1; SMN2MAPTKDM4ETDP1
SCHEMBL10195106 0.83 ALDH1A1 (0.42) ALDH1A1SMN1; SMN2MAPTPDE4BMEN1
SCHEMBL10195491 0.82 SMN1; SMN2 (0.44) ALDH1A1SMN1; SMN2MAPTKDM4ETDP1
SCHEMBL10187650 0.82 PDE4B (0.34) ALDH1A1SMN1; SMN2MAPTPDE4BLMNA
SCHEMBL10195173 0.81 HTR2A (0.39) ALDH1A1SMN1; SMN2MAPTKDM4ETDP1
SCHEMBL10195500 0.80 SMN1; SMN2 (0.39) ALDH1A1SMN1; SMN2MAPTKDM4ETDP1

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
EP-2387569-B1 HERBCIDES SYNGENTA LTD (GB) 2016-06-15 EP disclosed
US-20140378305-A1 NOVEL HERBICIDES SYNGENTA LIMITED (GB) 2014-12-25 US disclosed
US-20140378305-A1 NOVEL HERBICIDES SYNGENTA LIMITED (GB) 2014-12-25 US disclosed
US-8865623-B2 Herbicidally active cyclic diones and derivatives thereof, processes for their preparation, compositions, and method of controlling weeds SYNGENTA LIMITED (GB) 2014-10-21 US disclosed
US-8865623-B2 Herbicidally active cyclic diones and derivatives thereof, processes for their preparation, compositions, and method of controlling weeds SYNGENTA LIMITED (GB) 2014-10-21 US disclosed
US-20120021907-A1 NOVEL HERBICIDES SYNGENTA CROP PROTECTION LLC (US) 2012-01-26 US disclosed
US-20120021907-A1 NOVEL HERBICIDES SYNGENTA CROP PROTECTION LLC (US) 2012-01-26 US disclosed
WO-2010081755-A1 NOVEL HERBICIDES SYNGENTA LIMITED (GB) 2010-07-22 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-20140378305-A1 NOVEL HERBICIDES DDT, CYP4X1, CYP1B1 ALDH1A1 45/4885SMN1; SMN2 2218/4885MAPT 3785/4885
US-20120021907-A1 NOVEL HERBICIDES DDT, CYP4X1, CYP1B1 ALDH1A1 14/4885SMN1; SMN2 2952/4885MAPT 3903/4885

“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.