Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL1996456

O=C(O)C(F)(F)F.O=C(O)C(F)(F)F.O=S(=O)(c1cccnc1)n1cc(Cl)c2c3c(ccc21)OCCNC3

nearest known ligand 0.36

Full drug profile on Sugi Atlas →

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 6/20 0.36
KDM4E B2RXH2 1/20 0.35
CYP3A4 P08684 2/20 0.33
HTR2A P28223 1/20 0.33
HTR2C P28335 1/20 0.33
HTR2B P41595 1/20 0.33
HTT P42858 4/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
LMNA P02545 1/20 0.32
TSHR P16473 1/20 0.32
CHRNB2 P17787 1/20 0.32
CHRNA4 P43681 1/20 0.32
HPGD P15428 1/20 0.31
ACHE P22303 1/20 0.31
NR1H2 P55055 1/20 0.30
NR1H3 Q13133 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
SCHEMBL2002400 0.92 HTR6 (0.41) HTR6KDM4ECYP3A4HTR2AHTR2C
Trifluoroacetic Acid SCHEMBL1998224 0.91 HTR6 (0.40) HTR6CYP3A4HTR2AHTR2CHTR2B
Trifluoroacetic Acid SCHEMBL1992942 0.85 HTR6 (0.41) HTR6CYP3A4HTR2AHTR2CHTR2B
Trifluoroacetic Acid SCHEMBL2000044 0.84 HTR6 (0.39) HTR6CYP3A4HTR2AHTR2CHTR2B
Trifluoroacetic Acid SCHEMBL1994879 0.84 KDM4E (0.36) HTR6KDM4EHTTSMN1; SMN2LMNA
SCHEMBL2001693 0.83 HTR6 (0.46) HTR6CYP3A4HTR2AHTR2CHTR2B
SCHEMBL1999781 0.78 HTR6 (0.46) HTR6CYP3A4HTR2AHTR2CHTR2B
SCHEMBL1995792 0.75 HTR6 (0.36) HTR6KDM4ECYP3A4HTR2AHTR2C
SCHEMBL1997804 0.75 HTR6 (0.43) HTR6CYP3A4HTR2AHTR2CHTR2B
Trifluoroacetic Acid SCHEMBL1997380 0.75 HTR6 (0.38) HTR6CYP3A4HTR2AHTR2CHTR2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7960374-B2 e.g. 2,5-methylene-9-(phenylsulfonyl)-1,2,3,4,5,9-hexahydro[1,5]oxazocino[3,2-e]indole; serotonin receptors antagonist or partial agonist; metabolic diseases, e.g. obesity, insulin resisitance, type 2 diabetes, eating disorders; antidepressant, anxiolytic agent; cosmetics PROXIMAGEN LIMITED (GB) 2011-06-14 US disclosed
US-20080176829-A1 Compounds PROXIMAGEN NEUROSCIENCE PLC (GB) 2008-07-24 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-20080176829-A1 Compounds HTR6, HTR1B, HTR1A HTR6 1/4885KDM4E 3829/4885CYP3A4 381/4885

“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.