Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL566045

CCC[C@H](C)Oc1nc(N)c2nc(OC)[nH]c2n1.O=C(O)C(F)(F)F

nearest known ligand 0.36

Full drug profile on Sugi Atlas →

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TLR7 Q9NYK1 13/20 0.36
TLR8 Q9NR97 7/20 0.36
MCHR1 Q99705 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 SCHEMBL29697218 1.00 TLR7 (0.36) TLR7TLR8MCHR1
Trifluoroacetic Acid SCHEMBL2199289 1.00 TLR7 (0.36) TLR7TLR8MCHR1
SCHEMBL12157746 0.89 TLR7 (0.40) TLR7TLR8MCHR1
SCHEMBL1840777 0.89 TLR7 (0.40) TLR7TLR8MCHR1
SCHEMBL12157560 0.89 TLR7 (0.40) TLR7TLR8MCHR1
Trifluoroacetic Acid SCHEMBL2198204 0.88 AXL (0.34) TLR7MCHR1
Trifluoroacetic Acid SCHEMBL434419 0.83 TLR7 (0.33) TLR7
Trifluoroacetic Acid SCHEMBL2199668 0.83 ADORA2A (0.34)
SCHEMBL10121637 0.82 TLR7 (0.41) TLR7TLR8
Trifluoroacetic Acid SCHEMBL566788 0.82 TLR7 (0.39) TLR7

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 34 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10919894-B2 Adenine derivatives which are useful in the treatment of allergic diseases or other inflammatory conditions GLAXOSMITHKLINE BIOLOGICALS SA (BE) 2021-02-16 US disclosed
US-20200223849-A1 ADENINE DERIVATIVES WHICH ARE USEFUL IN THE TREATMENT OF ALLERGIC DISEASES OR OTHER INFLAMMATORY CONDITIONS GLAXOSMITHKLINE BIOLOGICALS SA (BE) 2020-07-16 US disclosed
US-10584125-B2 Adenine derivatives which are useful in the treatment of allergic diseases or other inflammatory conditions GLAXOSMITHKLINE BIOLOGICALS SA (BE) 2020-03-10 US disclosed
US-20190038631-A1 6-AMINO-PURIN-8-ONE COMPOUNDS GLAXOSMITHKLINE LLC 2019-02-07 US disclosed
US-10117873-B2 6-amino-purin-8-one compounds GLAXOSMITHKLINE LLC (US) 2018-11-06 US disclosed
US-20180291026-A1 ADENINE DERIVATIVES WHICH ARE USEFUL IN THE TREATMENT OF ALLERGIC DISEASES OR OTHER INFLAMMATORY CONDITIONS GLAXOSMITHKLINE BIOLOGICALS SA (BE) 2018-10-11 US disclosed
EP-3336089-A1 PURINE DERIVATIVES FOR USE IN THE TREATMENT OF ALLERGIC, INFLAMMATORY AND INFECTIOUS DISEASES GlaxoSmithKline LLC (US) 2018-06-20 EP disclosed
US-20180117048-A1 6-AMINO-PURIN-8-ONE COMPOUNDS GLAXOSMITHKLINE LLC 2018-05-03 US disclosed
US-9877968-B2 6-amino-purin-8-one compounds GLAXOSMITHKLINE LLC (US) 2018-01-30 US disclosed
EP-3246030-A1 NOVEL ADENINE DERIVATIVES GlaxoSmithKline LLC (US) 2017-11-22 EP disclosed
US-8067426-B2 6-amino-purin-8-one compounds GLAXOSMITHKLINE LLC (US) 2011-11-29 US disclosed
US-20110229500-A1 PURINE DERIVATIVES FOR USE IN THE TREATMENT OF ALLERGIC, INFLAMMATORY AND INFECTIOUS DISEASES GLAXOSMITHKLINE LLC (US) 2011-09-22 US disclosed
US-20110144136-A1 NOVEL ADENINE DERIVATIVES GLAXOSMITHKLINE LLC (US) 2011-06-16 US disclosed
US-20110135671-A1 PURINE DERIVATIVES FOR USE IN THE TREATMENT OF ALLERGIC, INFLAMMATORY AND INFECTIOUS DISEASES GLAXOSMITHKLINE LLC (US) 2011-06-09 US disclosed
US-20110135670-A1 PURINE DERIVATIVES FOR USE IN THE TREATMENT OF ALLERGIC, INFLAMMATORY AND INFECTIOUS DISEASES GLAXOSMITHKLINE LLC (US) 2011-06-09 US disclosed
EP-2324026-A1 PURINE DERIVATIVES FOR USE IN THE TREATMENT OF ALLERGIC, INFLAMMATORY AND INFECTIOUS DISEASES Smithkline Beecham Corporation (US) 2011-05-25 EP disclosed
US-20100075995-A1 COMPOUNDS SMITHKLINE BEECHAM CORPORATION (US) 2010-03-25 US disclosed
WO-2010018130-A1 PURINE DERIVATIVES FOR USE IN THE TREATMENT OF ALLERGIC, INFLAMMATORY AND INFECTIOUS DISEASES SMITHKLINE BEECHAM CORPORATION (US) 2010-02-18 WO disclosed
WO-2010018131-A1 PURINE DERIVATIVES FOR USE IN THE TREATMENT OF ALLERGIC, INFLAMMATORY AND INFECTIOUS DISEASES SMITHKLINE BEECHAM CORPORATION (US) 2010-02-18 WO disclosed
WO-2010018133-A1 PURINE DERIVATIVES FOR USE IN THE TREATMENT OF ALLERGIC, INFLAMMATORY AND INFECTIOUS DISEASES SMITHKLINE BEECHAM CORPORATION (US) 2010-02-18 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 (12 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-20110229500-A1 PURINE DERIVATIVES FOR USE IN THE TREATMENT OF ALLERGIC, INFLAMMATORY AND INFECTIOUS DISEASES IFNAR1, IFNG, STING1 TLR7 10/4885TLR8 88/4885MCHR1 2009/4885
US-20110135670-A1 PURINE DERIVATIVES FOR USE IN THE TREATMENT OF ALLERGIC, INFLAMMATORY AND INFECTIOUS DISEASES IFNAR1, IFNG, STING1 TLR7 19/4885TLR8 130/4885MCHR1 2572/4885
US-20180291026-A1 ADENINE DERIVATIVES WHICH ARE USEFUL IN THE TREATMENT OF ALLERGIC DISEASES OR OTHER INFLAMMATORY CONDITIONS HRH3, HRH4, HRH1 TLR7 15/4885TLR8 91/4885MCHR1 1220/4885
US-10584125-B2 Adenine derivatives which are useful in the treatment of allergic diseases or other inflammatory conditions HRH3, HRH4, HRH1 TLR7 15/4885TLR8 91/4885MCHR1 1220/4885
US-20110135671-A1 PURINE DERIVATIVES FOR USE IN THE TREATMENT OF ALLERGIC, INFLAMMATORY AND INFECTIOUS DISEASES IFNG, IFNAR1, STING1 TLR7 19/4885TLR8 174/4885MCHR1 1477/4885
US-20190038631-A1 6-AMINO-PURIN-8-ONE COMPOUNDS IFNG, IFNAR1, IRF3 TLR7 7/4885TLR8 15/4885MCHR1 2759/4885
US-10117873-B2 6-amino-purin-8-one compounds IFNG, IFNAR1, IRF3 TLR7 7/4885TLR8 15/4885MCHR1 2759/4885
US-20200223849-A1 ADENINE DERIVATIVES WHICH ARE USEFUL IN THE TREATMENT OF ALLERGIC DISEASES OR OTHER INFLAMMATORY CONDITIONS HRH3, HRH4, HRH1 TLR7 15/4885TLR8 89/4885MCHR1 1231/4885
US-20110144136-A1 NOVEL ADENINE DERIVATIVES STING1, IFNG, IFNAR1 TLR7 12/4885TLR8 212/4885MCHR1 2375/4885
US-20180117048-A1 6-AMINO-PURIN-8-ONE COMPOUNDS IFNG, IFNAR1, IRF3 TLR7 7/4885TLR8 15/4885MCHR1 2759/4885
US-20100075995-A1 COMPOUNDS IFNG, IRF3, IFNAR1 TLR7 8/4885TLR8 53/4885MCHR1 1789/4885
US-10919894-B2 Adenine derivatives which are useful in the treatment of allergic diseases or other inflammatory conditions HRH3, HRH4, HRH1 TLR7 15/4885TLR8 91/4885MCHR1 1220/4885

“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.