SCHEMBL124718

SCHEMBL124718

C=CCOc1ccc2cc(C(=O)O)c(C(F)(F)F)nc2n1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.40
TSHR P16473 1/20 0.40
HIF1A Q16665 1/20 0.36
ALDH1A1 P00352 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
F7 P08709 1/20 0.33
GFER P55789 1/20 0.33
HPGDS O60760 1/20 0.32
TP53 P04637 1/20 0.32
MAPT P10636 1/20 0.31
SCN9A Q15858 1/20 0.31
RXRA P19793 1/20 0.31
NR4A2 P43354 1/20 0.31
KDM4E B2RXH2 3/20 0.31
NPSR1 Q6W5P4 1/20 0.31
POLB P06746 1/20 0.31
PKM P14618 1/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
AGER Q15109 1/20 0.31

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
SCHEMBL123888 0.85 L3MBTL1 (0.48) GAAALDH1A1L3MBTL1GFERHPGDS
SCHEMBL124869 0.84 MAPT (0.40) TSHRHIF1AALDH1A1L3MBTL1GFER
SCHEMBL125140 0.81 HTT (0.38) ALDH1A1L3MBTL1GFERHPGDSSCN9A
SCHEMBL27838153 0.80 TDP1 (0.48) ALDH1A1GFERHPGDSKDM4EPOLB
SCHEMBL124068 0.77 MAPT (0.39) GAAALDH1A1GFERMAPTKDM4E
SCHEMBL126956 0.77 ALDH1A1 (0.39) ALDH1A1GFERRXRAKDM4ENPSR1
SCHEMBL122983 0.74 TAS2R14 (0.40) ALDH1A1GFERMAPTKDM4E
SCHEMBL125428 0.73 GFER (0.39) ALDH1A1GFERMAPTKDM4ENPSR1
SCHEMBL125418 0.72 KDM4E (0.47) TSHRHIF1AALDH1A1L3MBTL1GFER
SCHEMBL125802 0.72 GFER (0.43) ALDH1A1GFERRXRAKDM4ENPSR1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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

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 GAA 629/4885TSHR 1704/4885HIF1A 4506/4885

“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.