SCHEMBL125140

SCHEMBL125140

COCCOc1ccc2cc(C(=O)O)c(C(F)(F)F)nc2n1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.38
KDM4E B2RXH2 3/20 0.37
KMT2A Q03164 1/20 0.37
HPGDS O60760 1/20 0.36
SYK P43405 2/20 0.36
HPGD P15428 2/20 0.36
ALDH1A1 P00352 1/20 0.35
GFER P55789 1/20 0.35
SORT1 Q99523 2/20 0.34
RXFP1 Q9HBX9 1/20 0.34
TIPARP Q7Z3E1 1/20 0.34
ATF1 P18846 1/20 0.34
NFKB1 P19838 1/20 0.34
SCN9A Q15858 3/20 0.34
SCN10A Q9Y5Y9 1/20 0.34
P2RX7 Q99572 1/20 0.34
POLB P06746 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
CNR2 P34972 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33

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
SCHEMBL124869 0.86 MAPT (0.40) KDM4EHPGDSHPGDALDH1A1GFER
SCHEMBL123888 0.85 L3MBTL1 (0.48) HTTKDM4EKMT2AHPGDSALDH1A1
SCHEMBL27838153 0.85 TDP1 (0.48) KDM4EKMT2AHPGDSHPGDALDH1A1
SCHEMBL124718 0.81 GAA (0.40) KDM4EKMT2AHPGDSALDH1A1GFER
SCHEMBL125953 0.79 KDM4E (0.37) KDM4EHPGDALDH1A1GFER
SCHEMBL126956 0.79 ALDH1A1 (0.39) KDM4EKMT2AHPGDALDH1A1GFER
SCHEMBL124068 0.77 MAPT (0.39) HTTKDM4EKMT2AHPGDALDH1A1
SCHEMBL125428 0.76 GFER (0.39) KDM4EHPGDALDH1A1GFERSORT1
SCHEMBL3797028 0.75 GRM4 (0.42) HTTKDM4EKMT2ASYKHPGD
SCHEMBL125802 0.75 GFER (0.43) KDM4EKMT2AALDH1A1GFERSORT1

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 5 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
CN-102006777-A Herbicidal coumpounds SYNGENTA LTD 2011-04-06 CN disclosed
US-20110021352-A1 HERBICIDAL COMPOUNDS SYNGENTA CROP PROTECTION, INC. (US) 2011-01-27 US 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 HTT 930/4885KDM4E 1231/4885KMT2A 1162/4885

“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.