SCHEMBL4227499

SCHEMBL4227499

CCOC(=O)c1c(C(F)(F)F)c(C)nn1C

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.41
KDM4E B2RXH2 5/20 0.41
HPGD P15428 3/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
KMT2A Q03164 2/20 0.41
MAPT P10636 1/20 0.40
MAPK1 P28482 2/20 0.38
HSD17B10 Q99714 2/20 0.38
GAA P10253 2/20 0.38
CASP1 P29466 1/20 0.38
KLK7 P49862 1/20 0.38
POLB P06746 2/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
PDE4D Q08499 1/20 0.36

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
SCHEMBL13365015 0.88 KDM4E (0.47) ALDH1A1KDM4EHPGDL3MBTL1KMT2A
SCHEMBL2362756 0.86 KDM4E (0.40) ALDH1A1KDM4EHPGDKMT2AMAPT
SCHEMBL11900091 0.85 ALDH1A1 (0.42) ALDH1A1KDM4EHPGDL3MBTL1KMT2A
SCHEMBL13365021 0.85 ALDH1A1 (0.42) ALDH1A1KDM4EHPGDL3MBTL1KMT2A
SCHEMBL2362194 0.84 KDM4E (0.41) ALDH1A1KDM4EHPGDL3MBTL1KMT2A
SCHEMBL2363209 0.84 KDM4E (0.39) ALDH1A1KDM4EHPGDL3MBTL1KMT2A
SCHEMBL2363213 0.82 KDM4E (0.40) ALDH1A1KDM4EHPGDL3MBTL1KMT2A
SCHEMBL2363228 0.82 KDM4E (0.38) ALDH1A1KDM4EHPGDL3MBTL1KMT2A
SCHEMBL2363406 0.80 TSHR (0.39) ALDH1A1KDM4EHPGDL3MBTL1KMT2A
SCHEMBL30835646 0.78 CYP1A2 (0.50) ALDH1A1KDM4EHPGDKMT2AMAPT

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
US-20090042726-A1 Novel Herbicides SYNGENTA LIMITED (GB) 2009-02-12 US disclosed
US-20090042726-A1 Novel Herbicides SYNGENTA LIMITED (GB) 2009-02-12 US disclosed
US-20090042726-A1 Novel Herbicides SYNGENTA LIMITED (GB) 2009-02-12 US disclosed
EP-1965644-A1 NOVEL HERBICIDES Syngenta Limited (GB) 2008-09-10 EP disclosed
WO-2007071900-A1 NOVEL HERBICIDES SYNGENTA LIMITED (GB) 2007-06-28 WO disclosed
WO-2007071900-A1 NOVEL HERBICIDES SYNGENTA LIMITED (GB) 2007-06-28 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-20090042726-A1 Novel Herbicides DDT, CBR3, CBR1 ALDH1A1 271/4885KDM4E 1271/4885HPGD 1388/4885

“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.