Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL7106426

N=C(N)c1cccc([C@H]2C[C@H]2C(=O)Nc2ccc(-n3ccnc3)cc2)c1.O=C(O)C(F)(F)F.O=C(O)C(F)(F)F

nearest known ligand 0.53

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
F10 P00742 8/20 0.53
F9 P00740 1/20 0.53
NAMPT P43490 3/20 0.44
ALDH1A1 P00352 1/20 0.44
LMNA P02545 1/20 0.44
GAA P10253 1/20 0.44
HTT P42858 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
ABL1 P00519 1/20 0.42
JAK2 O60674 1/20 0.41
ROCK2 O75116 1/20 0.41
JAK1 P23458 1/20 0.41
TYK2 P29597 1/20 0.41
JAK3 P52333 1/20 0.41
ROCK1 Q13464 1/20 0.41
PRSS1 P07477 4/20 0.41
F2 P00734 3/20 0.41
PORCN Q9H237 2/20 0.41
HDAC4 P56524 1/20 0.40
DEGS1 O15121 1/20 0.40

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
SCHEMBL6166700 0.94 F10 (0.51) F10F9NAMPTALDH1A1LMNA
Trifluoroacetic Acid SCHEMBL6164329 0.83 DEGS1 (0.46) F10NAMPTALDH1A1LMNAGAA
Trifluoroacetic Acid SCHEMBL6167447 0.78 F10 (0.50) F10PRSS1F2DEGS1PRSS2
Trifluoroacetic Acid SCHEMBL6163953 0.78 F10 (0.51) F10PRSS1F2DEGS1PRSS2
Trifluoroacetic Acid SCHEMBL6163009 0.78 F10 (0.51) F10PRSS1F2DEGS1PRSS2
SCHEMBL6166706 0.76 NAMPT (0.45) NAMPTALDH1A1LMNAGAAHTT
SCHEMBL6163382 0.75 NAMPT (0.45) F10NAMPTALDH1A1LMNAGAA
Trifluoroacetic Acid SCHEMBL6165358 0.74 F10 (0.50) F10PRSS1F2PRSS2PRSS3
Trifluoroacetic Acid SCHEMBL6166608 0.74 F10 (0.43) F10PRSS1F2DEGS1PRSS2
Trifluoroacetic Acid SCHEMBL6165729 0.74 F10 (0.55) F10PRSS1F2PRSS2PRSS3

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-20030065176-A1 Factor xa inhibitors with aryl-amidines and derivatives, and prodrugs thereof LG CHEM INVESTMENT LTD. (KR) 2003-04-03 US claimed

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-20030065176-A1 Factor xa inhibitors with aryl-amidines and derivatives, and prodrugs thereof F2, F12, TFPI F10 11/4885F9 23/4885NAMPT 348/4885

“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.