Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL21403864

CCO[C@H]1C[C@H](N)C1.O=C(O)C(F)(F)F

nearest known ligand 0.34

Full drug profile on Sugi Atlas →

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SLC1A2 P43004 2/20 0.34
HTR2C P28335 2/20 0.33
GRM2 Q14416 1/20 0.32
GRM3 Q14832 1/20 0.32
DPP8 Q6V1X1 3/20 0.31
DPP7 Q9UHL4 2/20 0.31
DPP4 P27487 2/20 0.31
OAT P04181 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
Trifluoroacetic Acid SCHEMBL21403880 1.00 SLC1A2 (0.34) SLC1A2HTR2CGRM2GRM3DPP8
Trifluoroacetic Acid SCHEMBL21403865 1.00 SLC1A2 (0.34) SLC1A2HTR2CGRM2GRM3DPP8
Trifluoroacetic Acid SCHEMBL21403870 0.90 DPP8 (0.33) SLC1A2HTR2CGRM2GRM3DPP8
Trifluoroacetic Acid SCHEMBL20241254 0.86 SMYD3 (0.35) SLC1A2HTR2CDPP8DPP7DPP4
Trifluoroacetic Acid SCHEMBL21403856 0.86 SMYD3 (0.35) SLC1A2HTR2CDPP8DPP7DPP4
Trifluoroacetic Acid SCHEMBL30599171 0.81 CHRNB2 (0.33) SLC1A2HTR2C
SCHEMBL15297581 0.80
SCHEMBL12464408 0.80
Trifluoroacetic Acid SCHEMBL20241324 0.79 OAT (0.33) SLC1A2DPP4OAT
Trifluoroacetic Acid SCHEMBL21403917 0.79 OAT (0.33) SLC1A2DPP4OAT

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
US-20240279218-A1 ISOXAZOLYL ETHER DERIVATIVES AS GABA A ALPHA5 PAM HOFFMANN-LA ROCHE INC. (US) 2024-08-22 US disclosed
US-20220411415-A1 ISOXAZOLYL ETHER DERIVATIVES AS GABA A ALPHA5 PAM HOFFMANN-LA ROCHE INC. (US) 2022-12-29 US disclosed
EP-3551627-B1 NEW ISOXAZOLYL ETHER DERIVATIVES AS GABA A ALPHA5 PAM HOFFMANN LA ROCHE (CH) 2022-02-16 EP disclosed
US-11091471-B2 Isoxazolyl ether derivatives as GABAA α5 PAM HOFFMANN-LA ROCHE INC. (US) 2021-08-17 US disclosed
US-20190300516-A1 ISOXAZOLYL ETHER DERIVATIVES AS GABA A ALPHA5 PAM HOFFMANN-LA ROCHE INC. (US) 2019-10-03 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 (4 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-20190300516-A1 ISOXAZOLYL ETHER DERIVATIVES AS GABA A ALPHA5 PAM GABRA5, GABRB1, GABRA1 SLC1A2 148/4885HTR2C 459/4885GRM2 55/4885
US-20220411415-A1 ISOXAZOLYL ETHER DERIVATIVES AS GABA A ALPHA5 PAM GABRA5, GABRB1, GABRA1 SLC1A2 148/4885HTR2C 459/4885GRM2 55/4885
US-11091471-B2 Isoxazolyl ether derivatives as GABAA α5 PAM GABRA5, GABRA1, GABRA3 SLC1A2 207/4885HTR2C 337/4885GRM2 54/4885
US-20240279218-A1 ISOXAZOLYL ETHER DERIVATIVES AS GABA A ALPHA5 PAM GABRA5, GABRB1, GABRA1 SLC1A2 148/4885HTR2C 459/4885GRM2 55/4885

“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.