Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL3522567

NCCCCCN1CCN(CCCCCN)CC1.O=C(O)C(F)(F)F

nearest known ligand 0.59

Full drug profile on Sugi Atlas →

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CPB2 Q96IY4 2/20 0.47
CHRM2 P08172 2/20 0.45
CHRM4 P08173 2/20 0.45
CHRM5 P08912 2/20 0.45
CHRM1 P11229 2/20 0.45
CHRM3 P20309 2/20 0.45
SIGMAR1 Q99720 1/20 0.45
PAOX Q6QHF9 1/20 0.41

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 SCHEMBL4700421 0.91 CHRM2 (0.50) CPB2CHRM2CHRM4CHRM5CHRM1
Trifluoroacetic Acid SCHEMBL31657036 0.82 MEN1 (0.52) CPB2
Trifluoroacetic Acid SCHEMBL29682080 0.82 MEN1 (0.52) CPB2
Diaminooctane SCHEMBL31657050 0.82 MEN1 (0.52) CPB2
Trifluoroacetic Acid SCHEMBL31657055 0.82 MEN1 (0.52) CPB2
Trifluoroacetic Acid SCHEMBL3749229 0.81 SMN1; SMN2 (0.67) PAOX
SCHEMBL1614358 0.79 ALOX15 (0.58) SIGMAR1
Trifluoroacetic Acid SCHEMBL6490887 0.79 HRH4 (0.50) CPB2
SCHEMBL1614410 0.79 ALOX15 (0.58) SIGMAR1
SCHEMBL1614431 0.79 ALOX15 (0.58) SIGMAR1

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-7803804-B2 Substituted pyrazines for use in the treatment of inflammatory or allergic conditions NOVARTIS AG (CH) 2010-09-28 US disclosed
US-20080312217-A1 Organic Compounds NOVARTIS AG 2008-12-18 US disclosed
EP-1968969-A2 ORGANIC COMPOUNDS Novartis AG (CH) 2008-09-17 EP disclosed
WO-2007071396-A2 PYRAZINOYLGUANIDINE COMPOUNDS USEFUL IN THE TREATMENT OF INFLAMMATORY OR ALLERGIC CONDITIONS NOVARTIS AG (CH) 2007-06-28 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 (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-20080312217-A1 Organic Compounds TRPA1, TRPV1, CHRM1 CPB2 3834/4885CHRM2 19/4885CHRM4 36/4885

“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.