Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL6806174

CCC[C@H](NC(=O)[C@@H](NC)C(C)(C)c1ccccc1)C(=O)N(C)[C@H](/C=C(\C)C(=O)O)C(C)C.O=C(O)C(F)(F)F

nearest known ligand 0.58

Full drug profile on Sugi Atlas →

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TUBB1 Q9H4B7 2/20 0.58
MME P08473 1/20 0.32
MMP13 P45452 1/20 0.31
HDAC3 O15379 2/20 0.30
HDAC4 P56524 2/20 0.30
HDAC1 Q13547 2/20 0.30
HDAC2 Q92769 2/20 0.30
HDAC8 Q9BY41 2/20 0.30
MMP2 P08253 2/20 0.30
MMP1 P03956 1/20 0.30
MMP3 P08254 1/20 0.30
CTSK P43235 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
SCHEMBL6804948 0.96 TUBB1 (0.63) TUBB1MMEHDAC3HDAC4HDAC1
Trifluoroacetic Acid SCHEMBL6806455 0.91 TUBB1 (0.59) TUBB1MMP2MMP1MMP3CTSK
SCHEMBL6810366 0.89 TUBB1 (0.65) TUBB1MMEMMP13MMP2MMP3
SCHEMBL6809674 0.88 TUBB1 (0.62) TUBB1MMP13HDAC1MMP2MMP1
Trifluoroacetic Acid SCHEMBL6671228 0.88 TUBB1 (0.64) TUBB1MMP13CTSK
Taltobulin SCHEMBL30483111 0.88 TUBB1 (0.74) TUBB1MMP13MMP2MMP1MMP3
Trifluoroacetic Acid SCHEMBL6671230 0.88 TUBB1 (0.64) TUBB1MMP13CTSK
SCHEMBL6675810 0.87 TUBB1 (0.61) TUBB1MMP13MMP2MMP1MMP3
SCHEMBL6675817 0.87 TUBB1 (0.61) TUBB1MMP13MMP2MMP1MMP3
Trifluoroacetic Acid SCHEMBL6806056 0.87 TUBB1 (0.63) TUBB1CTSK

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-20040121965-A1 Method of treating resistant tumors WYETH HOLDINGS CORPORATION (US) 2004-06-24 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-20040121965-A1 Method of treating resistant tumors SLC11A2, VHL, REN TUBB1 199/4885MME 127/4885MMP13 293/4885

“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.