Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL3623906

O=C(O)C(F)(F)F.O=S(=O)(c1c(Cl)nc2sccn12)n1ccc2c(CN3CCC3)cccc21

nearest known ligand 0.53

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 12/20 0.53
HTR2C P28335 2/20 0.53
HTR7 P34969 2/20 0.53
ADRB2 P07550 1/20 0.53
CHRM2 P08172 1/20 0.53
ADRA2A P08913 1/20 0.53
S1PR1 P21453 1/20 0.53
C5AR1 P21730 1/20 0.53
SLC6A2 P23975 1/20 0.53
FPR3 P25089 1/20 0.53
HTR1D P28221 1/20 0.53
HTR1B P28222 1/20 0.53
HTR2A P28223 1/20 0.53
GPR183 P32249 1/20 0.53
ADRA1A P35348 1/20 0.53
HRH1 P35367 1/20 0.53
ADRA1B P35368 1/20 0.53
APLNR P35414 1/20 0.53
GLP1R P43220 1/20 0.53
HTR3A P46098 1/20 0.53

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
SCHEMBL3623245 0.93 HTR6 (0.58) HTR6HTR2CHTR7ADRB2CHRM2
SCHEMBL3623910 0.80 HTR6 (0.47) HTR6HTR2CHTR7ADRB2CHRM2
Trifluoroacetic Acid SCHEMBL3625913 0.80 HTR6 (0.52) HTR6HTR7CYP3A4CYP2D6
Trifluoroacetic Acid SCHEMBL3617270 0.78 HTR6 (0.68) HTR6HTR7HTR1DHTR1BCYP3A4
Trifluoroacetic Acid SCHEMBL3623393 0.78 HTR6 (0.48) HTR6CYP3A4CYP2D6
Trifluoroacetic Acid SCHEMBL3624424 0.78 HTR6 (0.53) HTR6CYP3A4CYP2D6
Trifluoroacetic Acid SCHEMBL3622318 0.78 HTR6 (0.52) HTR6HTR7CYP3A4CYP2D6
SCHEMBL1537789 0.77 HTR6 (0.63) HTR6HTR2CHTR7ADRB2CHRM2
Trifluoroacetic Acid SCHEMBL3616450 0.77 HTR6 (0.53) HTR6HTR7HTR1DHTR1BCYP3A4
Trifluoroacetic Acid SCHEMBL3622703 0.77 HTR6 (0.68) HTR6HTR7HTR1DHTR1BCYP3A4

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 1/4885HTR2C 15/4885HTR7 13/4885

“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.