Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL3616670

CCOc1ccc2c(ccn2S(=O)(=O)c2cc(Cl)ccc2Cl)c1CN(C)C.O=C(O)C(F)(F)F

nearest known ligand 0.40

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.40
SMN1; SMN2 Q16637 3/20 0.40
NPSR1 Q6W5P4 3/20 0.39
PTGDR2 Q9Y5Y4 2/20 0.39
PTGDR Q13258 1/20 0.39
MET P08581 1/20 0.39
MAPT P10636 4/20 0.38
LMNA P02545 2/20 0.37
KMT2A Q03164 2/20 0.36
CRHBP P24387 1/20 0.35
RECQL P46063 1/20 0.35
CRHR2 Q13324 1/20 0.35
THRB P10828 1/20 0.35
ALDH1A1 P00352 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
MEN1 O00255 1/20 0.34
GAA P10253 1/20 0.34
CPT1A P50416 1/20 0.34
CPT1B Q92523 1/20 0.34
CYP3A4 P08684 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
SCHEMBL3622471 0.92 TSHR (0.46) TSHRSMN1; SMN2NPSR1PTGDR2PTGDR
Trifluoroacetic Acid SCHEMBL3619138 0.90 HTR6 (0.40) TSHRSMN1; SMN2METLMNAKMT2A
Trifluoroacetic Acid SCHEMBL3624021 0.88 HTR6 (0.34) TSHRSMN1; SMN2NPSR1MAPTLMNA
Trifluoroacetic Acid SCHEMBL3626668 0.86 FABP4 (0.36) SMN1; SMN2KMT2AMEN1GAA
Trifluoroacetic Acid SCHEMBL3617556 0.83 CPT2 (0.42) TSHRSMN1; SMN2KMT2ARECQLALDH1A1
Trifluoroacetic Acid SCHEMBL3621025 0.83 HTR6 (0.46)
Trifluoroacetic Acid SCHEMBL3623471 0.82 HTR6 (0.47)
SCHEMBL3624772 0.81 HTR6 (0.45) TSHRSMN1; SMN2METLMNAKMT2A
Trifluoroacetic Acid SCHEMBL3620139 0.80 HTR6 (0.42) TSHR
Trifluoroacetic Acid SCHEMBL3620673 0.79 SLC2A1 (0.41) TSHRSMN1; SMN2MAPTLMNAKMT2A

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 TSHR 244/4885SMN1; SMN2 1529/4885NPSR1 12/4885

“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.