Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL1998592

COc1cc2c(ccn2S(=O)(=O)c2ccc(Cl)cc2Cl)c2c1OCCNC2C.O=C(O)C(F)(F)F

nearest known ligand 0.33

Full drug profile on Sugi Atlas →

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CPT1A P50416 10/20 0.33
CPT2 P23786 6/20 0.33
PTGDR Q13258 1/20 0.33
PTGDR2 Q9Y5Y4 1/20 0.33
CPT1B Q92523 6/20 0.32
FABP4 P15090 2/20 0.32
PPARG P37231 2/20 0.32
PPARD Q03181 2/20 0.32
PPARA Q07869 2/20 0.32
HTR6 P50406 2/20 0.32
HTT P42858 1/20 0.32
CYP3A4 P08684 1/20 0.31
CYP2C19 P33261 1/20 0.31

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
SCHEMBL1996300 0.93 HTR6 (0.35) PTGDRPTGDR2HTR6
Trifluoroacetic Acid SCHEMBL1995689 0.92 HTR6 (0.39) FABP4HTR6CYP3A4
Trifluoroacetic Acid SCHEMBL4562899 0.90 CPT2 (0.31) CPT1ACPT2CPT1B
Trifluoroacetic Acid SCHEMBL1994705 0.86 CPT2 (0.39) CPT1ACPT2CPT1BFABP4PPARG
Trifluoroacetic Acid SCHEMBL1997134 0.86 FABP4 (0.38) FABP4HTR6
SCHEMBL1995809 0.84 HTR6 (0.43) FABP4HTR6CYP3A4
Trifluoroacetic Acid SCHEMBL2002913 0.84 HTR6 (0.37) FABP4HTR6
SCHEMBL1998930 0.79 HTR6 (0.48) HTR6CYP3A4
SCHEMBL1999130 0.78 FABP4 (0.37) FABP4HTR6
SCHEMBL1997556 0.78 TSHR (0.42) CPT1ACPT2CPT1B

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 CPT1A 484/4885CPT2 1489/4885PTGDR 78/4885

“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.