Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL6806874

CN[C@H](C(=O)N[C@H](C(=O)N(C)[C@H](/C=C(\C)C(=O)NCCC#N)C(C)C)C(C)(C)C)C(C)(C)c1ccccc1.O=C(O)C(F)(F)F

nearest known ligand 0.57

Full drug profile on Sugi Atlas →

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ TUBB1 Q9H4B7 2/20 0.57
▸ MMP13 P45452 1/20 0.31
▸ CTSL P07711 1/20 0.31
▸ CTSS P25774 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
SCHEMBL6802822 0.96 TUBB1 (0.61) TUBB1CTSLCTSS
Trifluoroacetic Acid SCHEMBL6809618 0.89 TUBB1 (0.60) TUBB1MMP13
Trifluoroacetic Acid SCHEMBL6674557 0.88 TUBB1 (0.64) TUBB1MMP13
Trifluoroacetic Acid SCHEMBL6674546 0.88 TUBB1 (0.64) TUBB1MMP13
Trifluoroacetic Acid SCHEMBL6685615 0.88 TUBB1 (0.43) TUBB1CTSLCTSS
Trifluoroacetic Acid SCHEMBL6685619 0.87 TUBB1 (0.42) TUBB1CTSLCTSS
SCHEMBL6801949 0.86 TUBB1 (0.62) TUBB1
Taltobulin SCHEMBL30483111 0.86 TUBB1 (0.74) TUBB1MMP13
SCHEMBL6802182 0.84 TUBB1 (0.64) TUBB1
Trifluoroacetic Acid SCHEMBL6671681 0.84 TUBB1 (0.64) TUBB1MMP13

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 199/4885MMP13 293/4885CTSL 2059/4885

“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.

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