Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL6134916

CCCCC1(OC)CCNCC1.O=C(O)C(F)(F)F

nearest known ligand 0.35

Full drug profile on Sugi Atlas →

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
FUCA1 P04066 1/20 0.35
PKM P14618 1/20 0.33
CES2 O00748 4/20 0.33
FAAH O00519 8/20 0.32
SLC1A2 P43004 1/20 0.32
OPRM1 P35372 2/20 0.31
CES1 P23141 5/20 0.31
MEN1 O00255 1/20 0.31
CYP1A2 P05177 1/20 0.31
KMT2A Q03164 1/20 0.31
HSD17B10 Q99714 1/20 0.31
CYP2D6 P10635 1/20 0.31
SLC6A2 P23975 1/20 0.31
SLC6A4 P31645 1/20 0.31
SLC6A3 Q01959 1/20 0.31

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 SCHEMBL4275576 0.78 PKM (0.33) PKMCYP1A2
Trifluoroacetic Acid SCHEMBL6182271 0.76 OPRM1 (0.43) FUCA1PKMOPRM1MEN1KMT2A
SCHEMBL14310358 0.73
Trifluoroacetic Acid SCHEMBL4435632 0.73 PKM (0.38) PKMOPRM1KMT2A
SCHEMBL6134918 0.71 CES2 (0.33) CES2FAAH
Butyl Formate SCHEMBL27775054 0.70 FUCA1 (0.36) FUCA1CES2FAAHCES1
SCHEMBL30075732 0.70 ACHE (0.48) MEN1KMT2A
Trifluoroacetic Acid SCHEMBL3335470 0.69 OPRM1 (0.33) FUCA1PKMFAAHOPRM1KMT2A
SCHEMBL23579242 0.69 OPRM1 (0.34) OPRM1MEN1KMT2A
Trifluoroacetic Acid SCHEMBL5559583 0.69 PKM (0.35) PKMOPRM1SLC6A2SLC6A4SLC6A3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050004014-A1 Fungicides, microbiocides; glucanase inhibitor; prophylaxis, therapy for pneumocystis infections in humans, animals FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2005-01-06 US disclosed
WO-2004113368-A1 CYCLIC LIPOPEPTIDES ASTELLAS PHARMA INC. (JP) 2004-12-29 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-20050004014-A1 Fungicides, microbiocides; glucanase inhibitor; prophylaxis, therapy for pneumocystis infections in humans, animals MAN2B1, MAN2A1, MANBA FUCA1 151/4885PKM 2216/4885CES2 616/4885

“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.