Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL22345475

CCOP(=O)(O)CCc1c[n+](C)nc2ccccc12.O=C([O-])C(F)(F)F

nearest known ligand 0.34

Full drug profile on Sugi Atlas →

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ TBXAS1 P24557 1/20 0.34
▸ ACHE P22303 1/20 0.31
▸ CETP P11597 3/20 0.31
▸ PPARD Q03181 1/20 0.30

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
SCHEMBL22345481 0.90 TBXAS1 (0.37) TBXAS1CETPPPARD
SCHEMBL22345476 0.82 NPY5R (0.32) —
SCHEMBL22345536 0.81 NR1I2 (0.37) TBXAS1CETPPPARD
Trifluoroacetic Acid SCHEMBL22345557 0.78 HDAC6 (0.39) —
Iodide SCHEMBL22345422 0.78 NPY5R (0.35) PPARD
Trifluoroacetic Acid SCHEMBL22345576 0.78 PKM (0.43) TBXAS1ACHE
SCHEMBL22345526 0.72 NPY5R (0.43) ACHE
Iodide SCHEMBL22345589 0.71 NPY5R (0.42) ACHE
SCHEMBL22345559 0.70 CYP4F2 (0.34) —
SCHEMBL22345375 0.69 ACP3 (0.47) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220132847-A1 CINNOLINIUM COMPOUNDS FOR USE IN A METHOD OF CONTROLLING UNWANTED PLANT GROWTH SYNGENTA CROP PROTECTION AG (CH) 2022-05-05 — — US disclosed
EP-3924344-A1 CINNOLINIUM COMPOUNDS FOR USE IN A METHOD OF CONTROLLING UNWANTED PLANT GROWTH Syngenta Crop Protection AG (CH) 2021-12-22 — — EP disclosed
CN-113423694-A Cinnolinium compounds for use in a method for controlling unwanted plant growth 先正达农作物保护股份公司 2021-09-21 — — CN disclosed
WO-2020164970-A1 CINNOLINIUM COMPOUNDS FOR USE IN A METHOD OF CONTROLLING UNWANTED PLANT GROWTH SYNGENTA CROP PROTECTION AG (CH) 2020-08-20 — — 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-20220132847-A1 CINNOLINIUM COMPOUNDS FOR USE IN A METHOD OF CONTROLLING UNWANTED PLANT GROWTH NOTUM, DDT, CYP51A1 TBXAS1 4143/4885ACHE 365/4885CETP 4230/4885

“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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