Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL4491273

O=C(O)C(F)(F)F.OC[C@@H]1CCN1

nearest known ligand 0.47

Full drug profile on Sugi Atlas →

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CHRNB2 P17787 3/20 0.40
CHRNA4 P43681 3/20 0.40
AGL P35573 1/20 0.34
KDM1A O60341 1/20 0.33
FUCA1 P04066 1/20 0.33
SLC1A2 P43004 1/20 0.33

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 SCHEMBL27663777 0.86 CHRNB2 (0.41) CHRNB2CHRNA4
Trifluoroacetic Acid SCHEMBL31085834 0.83 CHRNB2 (0.43) CHRNB2CHRNA4KDM1ASLC1A2
Trifluoroacetic Acid SCHEMBL29134796 0.83 CHRNB2 (0.43) CHRNB2CHRNA4KDM1ASLC1A2
Oxalic Acid SCHEMBL4185610 0.82 AGL (0.39) AGLSLC1A2
Oxalic Acid SCHEMBL2112772 0.82 AGL (0.39) AGLSLC1A2
Trifluoroacetic Acid SCHEMBL17165596 0.82 CHRNB2 (0.37) CHRNB2CHRNA4AGLFUCA1
SCHEMBL640198 0.79
SCHEMBL6946814 0.79
SCHEMBL1189849 0.79
Trifluoroacetic Acid SCHEMBL28631777 0.78 SLC1A2 (0.38) CHRNB2CHRNA4KDM1ASLC1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7504390-B2 Benzoxazepine derivatives and their use as AMPA receptor stimulators N.V. ORGANON (NL) 2009-03-17 US disclosed
US-20080139529-A1 BENZOXAPZEPINE DERIVATIVES AND THEIR USE AS AMPA RECEPTOR STIMULATORS N.V. ORGANON (NL) 2008-06-12 US disclosed
EP-1399450-B1 BENZOXAZEPINE DERIVATIVES AND THEIR USE AS AMPA RECEPTOR STIMULATORS ORGANON NV (NL) 2008-03-19 EP disclosed
US-7307073-B2 Benzoxazepines derivatives and their use as AMPA receptor stimulators N.V. ORGANON (NL) 2007-12-11 US disclosed
CN-1257908-C Benzoxazepine derivatives and their use as AMPA receptor stimulators AKZO NOBEL NV (NL) 2006-05-31 CN disclosed
US-20040171605-A1 Benzoxazepines derivatives and their use as ampa receptor stimulators MERCK SHARP & DOHME B.V. (NL) 2004-09-02 US disclosed
CN-1514835-A Benzoxazepine derivatives and their use as AMPA receptor stimulators ��˹��ŵ�� 2004-07-21 CN disclosed
EP-1399450-A1 BENZOXAZEPINE DERIVATIVES AND THEIR USE AS AMPA RECEPTOR STIMULATORS Akzo Nobel N.V. (NL) 2004-03-24 EP disclosed
WO-2002100865-A1 BENZOXAZEPINE DERIVATIVES AND THEIR USE AS AMPA RECEPTOR STIMULATORS AKZO NOBEL N.V. (NL) 2002-12-19 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-20040171605-A1 Benzoxazepines derivatives and their use as ampa receptor stimulators CHRNA4, CHRNA10, CHRNA9 CHRNB2 56/4885CHRNA4 1/4885AGL 4317/4885
US-20080139529-A1 BENZOXAPZEPINE DERIVATIVES AND THEIR USE AS AMPA RECEPTOR STIMULATORS GRIN1, GRIA4, CHRNA4 CHRNB2 53/4885CHRNA4 3/4885AGL 4717/4885

“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.