Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL3040295

Cc1c(-c2ccc(CNC3Cc4ccccc4C3)c(F)c2)ccc2[nH]cnc12.O=C(O)C(F)(F)F

nearest known ligand 0.40

Full drug profile on Sugi Atlas →

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SLC2A1 P11166 6/20 0.40
PRMT5 O14744 1/20 0.39
OPRM1 P35372 3/20 0.38
OPRD1 P41143 3/20 0.38
OPRK1 P41145 3/20 0.38
HTR5A P47898 1/20 0.36
MTTP P55157 3/20 0.34
APOB P04114 2/20 0.34
SMO Q99835 3/20 0.33
ALOX5AP P20292 1/20 0.33
FEN1 P39748 1/20 0.33

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 SCHEMBL3044444 0.87 SLC2A1 (0.45) SLC2A1PRMT5HTR5AMTTPAPOB
SCHEMBL3040298 0.82 BDKRB1 (0.31) ALOX5APFEN1
SCHEMBL3047057 0.81 PRMT5 (0.39) PRMT5OPRM1OPRD1OPRK1ALOX5AP
Hydrochloric Acid SCHEMBL3046989 0.81 PRMT5 (0.38) PRMT5OPRM1OPRD1OPRK1
Hydrochloric Acid SCHEMBL3044195 0.81 PRMT5 (0.39) PRMT5OPRM1OPRD1OPRK1ALOX5AP
SCHEMBL13137013 0.78 ALOX5AP (0.36) SLC2A1OPRM1OPRD1OPRK1ALOX5AP
Hydrochloric Acid SCHEMBL3050595 0.78 PRMT5 (0.39) PRMT5OPRM1OPRD1OPRK1
Hydrochloric Acid SCHEMBL3044289 0.77 PDCD1 (0.34) OPRM1
SCHEMBL13137225 0.76 ALOX5AP (0.38) PRMT5OPRM1OPRD1OPRK1ALOX5AP
Hydrochloric Acid SCHEMBL3042171 0.76 PRMT5 (0.41) PRMT5OPRM1OPRD1OPRK1

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 4262/4885PRMT5 2811/4885OPRM1 2/4885

“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.