Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL4252856

CC1(N)CCCC1.O=C(O)C(F)(F)F

nearest known ligand 0.37

Full drug profile on Sugi Atlas →

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CPB2 Q96IY4 6/20 0.36
FFAR3 O14843 1/20 0.33
SLC1A2 P43004 2/20 0.33
ALDH1A1 P00352 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
F2 P00734 1/20 0.31
F11 P03951 1/20 0.31
PRSS1 P07477 1/20 0.31
PRSS2 P07478 1/20 0.31
PRSS3 P35030 1/20 0.31
DGAT1 O75907 1/20 0.30

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 SCHEMBL3558294 0.98 CPB2 (0.38) CPB2FFAR3SLC1A2ALDH1A1F2
Trifluoroacetic Acid SCHEMBL4250032 0.93 FFAR3 (0.38) CPB2FFAR3SLC1A2ALDH1A1TDP1
Bicarbonate SCHEMBL9097152 0.80 FFAR3 (0.39) FFAR3ALDH1A1TDP1
Trifluoroacetic Acid SCHEMBL22191335 0.79 ALDH1A1 (0.39) SLC1A2ALDH1A1TDP1F2F11
Trifluoroacetic Acid SCHEMBL3663048 0.79 CPB2 (0.36) CPB2SLC1A2ALDH1A1DGAT1
Carbamic Acid SCHEMBL2480642 0.78 ALDH1A1 (0.41) FFAR3ALDH1A1TDP1
Acetic Acid SCHEMBL2860441 0.78 ALDH1A1 (0.41) FFAR3SLC1A2ALDH1A1
Cycloleucine SCHEMBL27551133 0.77 NSD2 (0.39) CPB2ALDH1A1TDP1
Trifluoroacetic Acid SCHEMBL28157949 0.77 CPB2 (0.36) CPB2FFAR3DGAT1
Carbamic Acid SCHEMBL28841417 0.76 ALDH1A1 (0.39) FFAR3ALDH1A1

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-8188084-B2 Pyridinone and pyridazinone derivatives as inhibitors of poly (ADP-ribose) polymerase (PARP) ISTITUTO DI RICERCHE DI BIOLOGIA MOLECOLARE P. ANGELETTI SPA. (IT) 2012-05-29 US disclosed
US-20090176765-A1 Pyridinone and Pyridazinone Derivatives as Inhibitors of Poly (Adp-Ribose) Polymerase (Parp) MSD ITALIA S.R.L. (IT) 2009-07-09 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-20090176765-A1 Pyridinone and Pyridazinone Derivatives as Inhibitors of Poly (Adp-Ribose) Polymerase (Parp) PARP1, PARP2, PARP3 CPB2 1729/4885FFAR3 2866/4885SLC1A2 4508/4885

“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.