Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL23148992

COc1cc(COC2CNC2)ccc1F.O=C(O)C(F)(F)F

nearest known ligand 0.47

Full drug profile on Sugi Atlas →

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 2/20 0.40
ALKBH1 Q13686 1/20 0.39
DRD4 P21917 1/20 0.39
ROCK2 O75116 1/20 0.39
ROCK1 Q13464 1/20 0.39
SLC6A2 P23975 1/20 0.39
SLC6A3 Q01959 1/20 0.39
KCNH2 Q12809 1/20 0.39
BACE1 P56817 1/20 0.38

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
Trifluoroacetic Acid SCHEMBL20451601 0.79 NAAA (0.48)
SCHEMBL31071606 0.78 HTR2A (0.48) SLC6A4SLC6A2SLC6A3KCNH2
SCHEMBL23148993 0.77 DRD4 (0.42) ALKBH1DRD4BACE1
Trifluoroacetic Acid SCHEMBL25325427 0.76 SLC6A4 (0.45) SLC6A4
Trifluoroacetic Acid SCHEMBL23149100 0.74 HTR2C (0.49) SLC6A4
Trifluoroacetic Acid SCHEMBL30945211 0.74 IDO1 (0.47) SLC6A4
Trifluoroacetic Acid SCHEMBL31071587 0.74 SLC6A4 (0.54) SLC6A4KCNH2
Trifluoroacetic Acid SCHEMBL23149062 0.73 LMNA (0.43) SLC6A4ALKBH1SLC6A2SLC6A3KCNH2
Trifluoroacetic Acid SCHEMBL21381868 0.71 HTR2A (0.44) SLC6A4SLC6A2SLC6A3
Trifluoroacetic Acid SCHEMBL23152297 0.71 IDO1 (0.47) SLC6A4SLC6A2SLC6A3

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
EP-4034538-A1 NEW HETEROCYCLIC MONOACYLGLYCEROL LIPASE (MAGL) INHIBITORS F. Hoffmann-La Roche AG (CH) 2022-08-03 EP disclosed
CN-114401968-A Novel heterocyclic monoacylglycerol lipase (MAGL) inhibitors 豪夫迈·罗氏有限公司 2022-04-26 CN disclosed
WO-2021058445-A1 NEW HETEROCYCLIC MONOACYLGLYCEROL LIPASE (MAGL) INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2021-04-01 WO disclosed
US-20210094973-A1 HETEROCYCLIC COMPOUNDS HOFFMANN-LA ROCHE INC. (US) 2021-04-01 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-20210094973-A1 HETEROCYCLIC COMPOUNDS H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, CYP1A1, CYP1B1 SLC6A4 3942/4885ALKBH1 1275/4885DRD4 572/4885

“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.