SCHEMBL125953

SCHEMBL125953

COCc1ccc2cc(C(=O)O)c(C(F)(F)F)nc2n1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.37
NPSR1 Q6W5P4 1/20 0.37
GFER P55789 1/20 0.37
KDM5A P29375 1/20 0.36
KDM5B Q9UGL1 1/20 0.36
RAB9A P51151 1/20 0.35
HCAR2 Q8TDS4 1/20 0.35
ALDH1A1 P00352 3/20 0.35
HPGD P15428 3/20 0.35
HSD17B10 Q99714 2/20 0.35
USP2 O75604 1/20 0.35
CYP2C19 P33261 1/20 0.35
SLC16A3 O15427 2/20 0.34
ALOX15 P16050 1/20 0.34
SLC16A1 P53985 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
MRGPRX4 Q96LA9 3/20 0.33
IDO1 P14902 1/20 0.33
MAPT P10636 2/20 0.32
S1PR4 O95977 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
SCHEMBL125428 0.87 GFER (0.39) KDM4ENPSR1GFERALDH1A1HPGD
SCHEMBL123290 0.86 KDM4E (0.49) KDM4ENPSR1ALDH1A1HPGDIDO1
SCHEMBL27838153 0.80 TDP1 (0.48) KDM4EGFERALDH1A1HPGDHSD17B10
SCHEMBL124869 0.80 MAPT (0.40) KDM4ENPSR1GFERRAB9AALDH1A1
SCHEMBL125140 0.79 HTT (0.38) KDM4EGFERALDH1A1HPGD
SCHEMBL125802 0.78 GFER (0.43) KDM4ENPSR1GFERALDH1A1
SCHEMBL122983 0.76 TAS2R14 (0.40) KDM4EGFERALDH1A1HPGDHSD17B10
SCHEMBL126778 0.76 GFER (0.36) KDM4ENPSR1GFERALDH1A1HPGD
SCHEMBL125060 0.76 GFER (0.39) KDM4ENPSR1GFERALDH1A1HPGD
SCHEMBL28008297 0.76 GFER (0.39) KDM4ENPSR1GFERALDH1A1HPGD

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
CN-102006777-B Herbicidal compounds SYNGENTA LTD 2015-04-01 CN disclosed
US-8461083-B2 Herbicidal compounds SYNGENTA LIMITED (GB) 2013-06-11 US disclosed
EP-2265120-B1 HERBICIDAL COUMPOUNDS SYNGENTA LTD (GB) 2012-03-07 EP disclosed
US-20110021352-A1 HERBICIDAL COMPOUNDS SYNGENTA CROP PROTECTION, INC. (US) 2011-01-27 US disclosed
EP-2265120-A1 HERBICIDAL COUMPOUNDS Syngenta Limited (GB) 2010-12-29 EP disclosed
WO-2009115788-A1 HERBICIDAL COUMPOUNDS SYNGENTA LIMITED (GB) 2009-09-24 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-20110021352-A1 HERBICIDAL COMPOUNDS RDX, NQO2, DDT KDM4E 1231/4885NPSR1 683/4885GFER 986/4885

“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.