Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL4700418

NC(=O)CCCN1CCCC1.O=C(O)C(F)(F)F

nearest known ligand 0.58

Full drug profile on Sugi Atlas →

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.58
CYP1A2 P05177 1/20 0.56
MAPK1 P28482 1/20 0.56
SMN1; SMN2 Q16637 1/20 0.56
MAPT P10636 3/20 0.41
ALDH1A1 P00352 3/20 0.41
CHRM2 P08172 2/20 0.41
CHRM4 P08173 2/20 0.41
CHRM5 P08912 2/20 0.41
CHRM1 P11229 2/20 0.41
CHRM3 P20309 2/20 0.41
POLB P06746 1/20 0.41
ARG1 P05089 4/20 0.41
ARG2 P78540 3/20 0.41
HRH3 Q9Y5N1 2/20 0.39
ALOX15 P16050 1/20 0.38
CACNA1B Q00975 2/20 0.37

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
SCHEMBL3926676 0.87 L3MBTL1 (0.75) L3MBTL1CYP1A2MAPK1SMN1; SMN2MAPT
Hydrochloric Acid SCHEMBL4710262 0.85 L3MBTL1 (0.72) L3MBTL1CYP1A2MAPK1SMN1; SMN2MAPT
SCHEMBL493879 0.85 L3MBTL1 (0.79) L3MBTL1CYP1A2MAPK1SMN1; SMN2MAPT
Hydrochloric Acid SCHEMBL2710255 0.83 L3MBTL1 (0.76) L3MBTL1CYP1A2MAPK1SMN1; SMN2MAPT
SCHEMBL3321939 0.82 L3MBTL1 (0.68) L3MBTL1CYP1A2MAPK1SMN1; SMN2MAPT
Trifluoroacetic Acid SCHEMBL4700421 0.82 CHRM2 (0.50) L3MBTL1CYP1A2MAPK1SMN1; SMN2CHRM2
SCHEMBL2877981 0.81 L3MBTL1 (0.72) L3MBTL1CYP1A2MAPK1SMN1; SMN2MAPT
Trifluoroacetic Acid SCHEMBL16701135 0.80 CYP1A2 (0.48) L3MBTL1CYP1A2MAPK1SMN1; SMN2MAPT
Trifluoroacetic Acid SCHEMBL4541214 0.79 KDM4E (0.48) L3MBTL1SMN1; SMN2ALDH1A1CHRM2CHRM4
SCHEMBL10624598 0.79 L3MBTL1 (0.69) L3MBTL1CYP1A2MAPK1SMN1; SMN2MAPT

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
EP-1926737-B1 4-AMINO-THIENO[3,2-C]PYRIDINE-7-CARBOXYLIC ACID DERIVATIVES HOFFMANN LA ROCHE (CH) 2017-03-15 EP claimed
EP-1926737-B1 4-AMINO-THIENO[3,2-C]PYRIDINE-7-CARBOXYLIC ACID DERIVATIVES HOFFMANN LA ROCHE (CH) 2017-03-15 EP disclosed
EP-1926737-A1 4-AMINO-THIENO[3,2-C]PYRIDINE-7-CARBOXYLIC ACID DERIVATIVES F.HOFFMANN-LA ROCHE AG (CH) 2008-06-04 EP disclosed
WO-2007031428-A1 4-AMINO-THIENO[3,2-C]PYRIDINE-7-CARBOXYLIC ACID DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2007-03-22 WO disclosed
US-20070060607-A1 4-amino-thieno[3,2-c] pyridine-7-carboxylic acid derivatives BARTKOVITZ DAVID J 2007-03-15 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-20070060607-A1 4-amino-thieno[3,2-c] pyridine-7-carboxylic acid derivatives BRAF, RAF1, MAP3K7 L3MBTL1 4160/4885CYP1A2 1747/4885MAPK1 62/4885

“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.