Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL3652182

COc1ccc2[nH]ccc2c1CN(C)C.COc1ccc2c(ccn2S(=O)(=O)c2cccc(C(F)(F)F)c2)c1CN(C)C.O=C(O)C(F)(F)F

nearest known ligand 0.41

Full drug profile on Sugi Atlas →

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 12/20 0.41
PPARG P37231 3/20 0.37
PPARD Q03181 3/20 0.37
PPARA Q07869 3/20 0.37
CACNA1B Q00975 2/20 0.36
RORC P51449 2/20 0.35
MTNR1A P48039 1/20 0.35
MTNR1B P49286 1/20 0.35
CACNA1C Q13936 1/20 0.34

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 SCHEMBL3615740 0.92 HTR6 (0.46) HTR6PPARGPPARDPPARACACNA1B
SCHEMBL3620777 0.87 HTR6 (0.48) HTR6CACNA1BCACNA1C
Trifluoroacetic Acid SCHEMBL4020623 0.78 MTNR1A (0.52) MTNR1AMTNR1B
Trifluoroacetic Acid SCHEMBL3625968 0.77 HTR6 (0.53) HTR6RORC
SCHEMBL3619807 0.75 HTR6 (0.62) HTR6
Trifluoroacetic Acid SCHEMBL3615844 0.75 CPT2 (0.45) HTR6PPARGPPARDPPARA
Trifluoroacetic Acid SCHEMBL3621025 0.74 HTR6 (0.46) HTR6
Hydrochloric Acid SCHEMBL3623637 0.74 HTR6 (0.60) HTR6
Trifluoroacetic Acid SCHEMBL3624798 0.74 HTR6 (0.47) HTR6
Trifluoroacetic Acid SCHEMBL3622250 0.74 FABP4 (0.44) HTR6PPARGPPARDPPARA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2046741-B1 INDOLES AS 5-HT6 MODULATORS PROXIMAGEN LTD (GB) 2012-10-31 EP disclosed
US-7812017-B2 4-substituted indole and indoline compounds BIOVITRUM AB (PUBL.) (SE) 2010-10-12 US disclosed
EP-2046741-A1 INDOLES AS 5-HT6 MODULATORS BIOVITRUM AB (publ) (SE) 2009-04-15 EP disclosed
US-20080032968-A1 New compounds PROXIMAGEN NEUROSCIENCE PLC (GB) 2008-02-07 US disclosed
WO-2008003703-A1 INDOLES AS 5-HT6 MODULATORS BIOVITRUM AB (PUBL) (SE) 2008-01-10 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-20080032968-A1 New compounds HTR6, HTR1B, HTR1A HTR6 1/4885PPARG 1458/4885PPARD 1311/4885

“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.