Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL4334749

O=C(Nc1ccncn1)c1nc(-c2ccccc2F)n2ccccc12.O=C(O)C(F)(F)F.O=C(O)C(F)(F)F

nearest known ligand 0.44

Full drug profile on Sugi Atlas →

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CHRNB2 P17787 1/20 0.44
CHRNB4 P30926 1/20 0.44
CHRNA3 P32297 1/20 0.44
CHRNA4 P43681 1/20 0.44
MPL P40238 10/20 0.40
ATR Q13535 2/20 0.37
POLB P06746 1/20 0.35
HPGD P15428 1/20 0.35
MAPK1 P28482 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
NAMPT P43490 1/20 0.35
IDO1 P14902 1/20 0.34

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
SCHEMBL13578319 0.95 CHRNB2 (0.46) CHRNB2CHRNB4CHRNA3CHRNA4MPL
Trifluoroacetic Acid SCHEMBL4327609 0.91 MPL (0.43) CHRNB2CHRNB4CHRNA3CHRNA4MPL
Trifluoroacetic Acid SCHEMBL4332928 0.90 CHRNB2 (0.40) CHRNB2CHRNB4CHRNA3CHRNA4MPL
Trifluoroacetic Acid SCHEMBL4329922 0.90 MPL (0.44) CHRNB2CHRNB4CHRNA3CHRNA4MPL
Trifluoroacetic Acid SCHEMBL4319198 0.90 CHRNB2 (0.43) CHRNB2CHRNB4CHRNA3CHRNA4MPL
Trifluoroacetic Acid SCHEMBL4319298 0.89 CHRNB2 (0.46) CHRNB2CHRNB4CHRNA3CHRNA4MPL
Trifluoroacetic Acid SCHEMBL4329693 0.89 CHRNB2 (0.43) CHRNB2CHRNB4CHRNA3CHRNA4MPL
Trifluoroacetic Acid SCHEMBL4339704 0.87 CHRNB2 (0.41) CHRNB2CHRNB4CHRNA3CHRNA4MPL
Trifluoroacetic Acid SCHEMBL4324540 0.87 L3MBTL1 (0.45) CHRNB2CHRNB4CHRNA3CHRNA4MPL
SCHEMBL13578330 0.87 MPL (0.46) CHRNB2CHRNB4CHRNA3CHRNA4MPL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090325936-A1 IMIDAZOPYRIDINE ANALOGS AS CB2 RECEPTOR MODULATORS, USEFUL IN THE TREATMENT OF PAIN, RESPIRATORY AND NON-RESPIRATORY DISEASES MERCK & CO., INC. 2009-12-31 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-20090325936-A1 IMIDAZOPYRIDINE ANALOGS AS CB2 RECEPTOR MODULATORS, USEFUL IN THE TREATMENT OF PAIN, RESPIRATORY AND NON-RESPIRATORY DISEASES CNR2, CNR1, TRPV1 CHRNB2 199/4885CHRNB4 188/4885CHRNA3 102/4885

“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.