Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL5628829

NC(=O)C1SC2C=CC=CC2C1NC(=O)c1cccnc1.NCc1cccc(C(=O)N(CC(=O)O)c2ccccc2)c1.O=C(O)C(F)(F)F.O=C(O)C(F)(F)F

nearest known ligand 0.36

Full drug profile on Sugi Atlas →

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.36
TSHR P16473 1/20 0.36
HTT P42858 1/20 0.33
POLQ O75417 1/20 0.33
MEN1 O00255 1/20 0.32
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
KMT2A Q03164 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
TPSAB1 Q15661 1/20 0.31
HDAC1 Q13547 1/20 0.31
CPB2 Q96IY4 1/20 0.31
CHRNB2 P17787 2/20 0.30
CHRNA7 P36544 2/20 0.30
CHRNA4 P43681 2/20 0.30
LMNA P02545 1/20 0.30
PDK1 Q15118 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 SCHEMBL5626916 0.93 HDAC11 (0.32)
Trifluoroacetic Acid SCHEMBL5631027 0.86 F11 (0.32) MEN1KMT2A
Trifluoroacetic Acid SCHEMBL5629214 0.83 F2 (0.32)
Trifluoroacetic Acid SCHEMBL5627045 0.80 FOLH1 (0.39)
Trifluoroacetic Acid SCHEMBL5626942 0.79 FOLH1 (0.33) LMNA
SCHEMBL5208588 0.79 F2 (0.34) GAATSHR
SCHEMBL5204891 0.75 KMT2A (0.33) MEN1KMT2ALMNA
SCHEMBL5209352 0.75 F2 (0.34) MEN1KMT2A
Trifluoroacetic Acid SCHEMBL5206988 0.75 FOLH1 (0.35) TPSAB1CPB2
Trifluoroacetic Acid SCHEMBL5212701 0.73 LOXL2 (0.31)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7157585-B2 Serine protease inhibitors TULARIK LIMITED (GB) 2007-01-02 US disclosed
US-20050215587-A1 Serine protease inhibitors LIVELY SARAH E 2005-09-29 US disclosed
US-6916957-B2 Serine protease inhibitors TULARIK LIMITED (GB) 2005-07-12 US disclosed
US-20030018059-A1 Serine protease inhibitors PROTHERICS MOLECULAR DESIGN LIMITED (GB) 2003-01-23 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 (2 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-20050215587-A1 Serine protease inhibitors PRSS1, TPSAB1, CMA1 GAA 684/4885TSHR 2267/4885HTT 3602/4885
US-20030018059-A1 Serine protease inhibitors TPSAB1, PRSS1, SERPINB1 GAA 843/4885TSHR 3554/4885HTT 4586/4885

“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.