SCHEMBL27176554

SCHEMBL27176554

O=C(O)C(F)(F)c1c(Cl)ccc2cc(Cl)cnc12

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALK Q9UM73 1/20 0.39
▸ PAX8 Q06710 1/20 0.34
▸ L3MBTL1 Q9Y468 2/20 0.33
▸ GLA P06280 1/20 0.33
▸ HPGD P15428 1/20 0.33
▸ LMNA P02545 1/20 0.33
▸ CCR9 P51686 1/20 0.32
▸ F7 P08709 1/20 0.32
▸ F3 P13726 1/20 0.32
▸ KCNN4 O15554 1/20 0.32
▸ GRIN2D O15399 1/20 0.32
▸ GRIN3B O60391 1/20 0.32
▸ GRIN1 Q05586 1/20 0.32
▸ GRIN2A Q12879 1/20 0.32
▸ GRIN2B Q13224 1/20 0.32
▸ GRIN2C Q14957 1/20 0.32
▸ GRIN3A Q8TCU5 1/20 0.32
▸ PTPN6 P29350 1/20 0.32
▸ PTPN11 Q06124 1/20 0.32
▸ HTT P42858 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
SCHEMBL30707926 1.00 ALK (0.39) ALKPAX8L3MBTL1GLAHPGD
SCHEMBL30707958 0.84 MAPK1 (0.34) ALKL3MBTL1HPGD
SCHEMBL27176543 0.84 MAPK1 (0.34) ALKL3MBTL1HPGD
SCHEMBL27176595 0.78 ALDH1A1 (0.44) L3MBTL1HPGDLMNAPTPN6PTPN11
SCHEMBL10879585 0.78 CCR1 (0.35) ALKL3MBTL1LMNAGRIN2DGRIN3B
SCHEMBL13990321 0.75 CCR1 (0.37) ALKLMNAGRIN2DGRIN3BGRIN1
Quinclorac SCHEMBL55011 0.74 ALK (0.63) ALKL3MBTL1LMNAF7F3
Quinclorac SCHEMBL4897414 0.74 ALK (0.63) ALKL3MBTL1LMNAF7F3
Quinclorac SCHEMBL29371402 0.74 ALK (0.63) ALKL3MBTL1LMNAF7F3
Quinclorac SCHEMBL3108911 0.73 ALK (0.62) ALKL3MBTL1LMNAF7F3

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-20240251792-A1 WEED CONTROL METHOD SYNGENTA CROP PROTECTION AG (CH) 2024-08-01 — — US disclosed
EP-4340614-A1 WEED CONTROL METHOD Syngenta Crop Protection AG (CH) 2024-03-27 — — EP disclosed
WO-2022243155-A1 WEED CONTROL METHOD SYNGENTA CROP PROTECTION AG (CH) 2022-11-24 — — 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-20240251792-A1 WEED CONTROL METHOD NOTUM, WEE1, GLRX3 ALK 1745/4885PAX8 1211/4885L3MBTL1 1268/4885

“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.

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