Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL3047253

Cc1nc2nc[nH]c2cc1-c1ccc(CNC2Cc3ccccc3C2)cc1.O=C(O)C(F)(F)F

nearest known ligand 0.46

Full drug profile on Sugi Atlas →

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SLC2A1 P11166 5/20 0.46
HTR5A P47898 1/20 0.44
MTTP P55157 3/20 0.44
APOB P04114 2/20 0.44
SMO Q99835 8/20 0.41
HDAC1 Q13547 1/20 0.40
FYN P06241 1/20 0.36
GRIN2B Q13224 1/20 0.36

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
SCHEMBL13137039 0.91 GRIN2B (0.40) SLC2A1MTTPAPOBSMOHDAC1
Trifluoroacetic Acid SCHEMBL3047273 0.85 OPRM1 (0.36) SLC2A1HTR5AHDAC1
Trifluoroacetic Acid SCHEMBL3050605 0.85 SLC2A1 (0.48) SLC2A1HTR5AMTTPAPOBSMO
Trifluoroacetic Acid SCHEMBL3044444 0.82 SLC2A1 (0.45) SLC2A1HTR5AMTTPAPOBSMO
Trifluoroacetic Acid SCHEMBL3048634 0.82 SLC2A1 (0.45) SLC2A1HTR5AMTTPAPOBSMO
Trifluoroacetic Acid SCHEMBL3043806 0.82 SLC2A1 (0.45) SLC2A1HTR5AMTTPAPOBSMO
SCHEMBL3047256 0.81 HSD11B1 (0.32) SLC2A1MTTPAPOB
Trifluoroacetic Acid SCHEMBL3050323 0.80 SLC2A1 (0.51) SLC2A1HTR5AMTTPAPOBSMO
Trifluoroacetic Acid SCHEMBL3048446 0.79 HTR5A (0.41) SLC2A1HTR5A
SCHEMBL13137046 0.75 OPRM1 (0.35)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100222345-A1 NOVEL COMPOUNDS AS ANTAGONISTS OR INVERSE AGONISTS FOR OPIOID RECEPTORS SMITHKLINE BEECHAM CORPORATION 2010-09-02 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-20100222345-A1 NOVEL COMPOUNDS AS ANTAGONISTS OR INVERSE AGONISTS FOR OPIOID RECEPTORS OPRL1, OPRM1, OPRK1 SLC2A1 4262/4885HTR5A 190/4885MTTP 2779/4885

“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.