Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL21590922

Clc1cc(OC2CNC2)ccn1.O=C(O)C(F)(F)F

nearest known ligand 0.47

Full drug profile on Sugi Atlas →

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 2/20 0.44
SLC6A2 P23975 1/20 0.44
SLC6A3 Q01959 1/20 0.44
LNPEP Q9UIQ6 1/20 0.39
HTR2C P28335 1/20 0.39
HTR2B P41595 1/20 0.39

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
SCHEMBL30694895 0.86 SLC6A4 (0.57) SLC6A4SLC6A2SLC6A3
Trifluoroacetic Acid SCHEMBL21590734 0.81
Trifluoroacetic Acid SCHEMBL23830840 0.78 SLC6A2 (0.47) SLC6A4SLC6A2SLC6A3
Trifluoroacetic Acid SCHEMBL21723079 0.77 SLC6A4 (0.55) SLC6A4SLC6A2SLC6A3
Trifluoroacetic Acid SCHEMBL23830800 0.76 SLC6A2 (0.45) SLC6A4SLC6A2SLC6A3
Trifluoroacetic Acid SCHEMBL30619319 0.75 TACR1 (0.41) SLC6A4LNPEP
Trifluoroacetic Acid SCHEMBL23830644 0.75 SLC6A4 (0.48) SLC6A4SLC6A2SLC6A3
Trifluoroacetic Acid SCHEMBL23831006 0.75 GRIN1 (0.43)
Trifluoroacetic Acid SCHEMBL21590609 0.75 SLC6A2 (0.49) SLC6A4SLC6A2SLC6A3
Trifluoroacetic Acid SCHEMBL28921589 0.75 SLC6A4 (0.48) 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
US-11840528-B2 Isoxazolyl ether derivatives as GABAA α5 PAM HOFFMANN-LA ROCHE INC. (US) 2023-12-12 US disclosed
EP-3807269-A1 NEW ISOXAZOLYL ETHER DERIVATIVES AS GABA A ALPHA5 PAM F. Hoffmann-La Roche AG (CH) 2021-04-21 EP disclosed
US-20210094945-A1 NEW ISOXAZOLYL ETHER DERIVATIVES AS GABA A ALPHA5 PAM HOFFMANN-LA ROCHE INC. (US) 2021-04-01 US disclosed
WO-2019238633-A1 NEW ISOXAZOLYL ETHER DERIVATIVES AS GABA A ALPHA5 PAM F. HOFFMANN-LA ROCHE AG (CH) 2019-12-19 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 (2 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-11840528-B2 Isoxazolyl ether derivatives as GABAA α5 PAM GABRA5, GABRA2, GABRB2 SLC6A4 729/4885SLC6A2 1136/4885SLC6A3 710/4885
US-20210094945-A1 NEW ISOXAZOLYL ETHER DERIVATIVES AS GABA A ALPHA5 PAM GABRA5, GABRB2, GABRB1 SLC6A4 867/4885SLC6A2 1814/4885SLC6A3 827/4885

“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.