Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL1497372

C=CC(=O)Nc1ccc(CCN)cc1.O=C(O)C(F)(F)F

nearest known ligand 0.54

Full drug profile on Sugi Atlas →

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ TGM2 P21980 13/20 0.54
▸ THRA P10827 1/20 0.53
▸ THRB P10828 1/20 0.53
▸ F13A1 P00488 4/20 0.46
▸ TGM1 P22735 4/20 0.46
▸ LMNA P02545 1/20 0.46
▸ TGM3 Q08188 1/20 0.46
▸ CTSC P53634 1/20 0.44
▸ ITGB3 P05106 2/20 0.41
▸ ITGB1 P05556 2/20 0.41
▸ ITGAV P06756 2/20 0.41
▸ ITGA5 P08648 2/20 0.41
▸ CDK14 O94921 2/20 0.40
▸ CCNY Q8ND76 2/20 0.40
▸ ITGB2 P05107 1/20 0.40
▸ ITGB5 P18084 1/20 0.40
▸ ITGB6 P18564 1/20 0.40
▸ ITGAL P20701 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
SCHEMBL12265208 0.90 THRA (0.63) TGM2THRATHRBF13A1TGM1
SCHEMBL16653882 0.77 TGM2 (0.59) TGM2THRATHRBF13A1TGM1
Trifluoroacetic Acid SCHEMBL30182563 0.77 HDAC3 (0.46) ITGB3ITGB1ITGAVITGA5
Trifluoroacetic Acid SCHEMBL29803202 0.76 NR1H4 (0.53) LMNA
SCHEMBL8867192 0.76 THRA (0.65) TGM2THRATHRBF13A1TGM1
SCHEMBL8867209 0.76 THRA (0.65) TGM2THRATHRBF13A1TGM1
Trifluoroacetic Acid SCHEMBL30182723 0.75 TAAR1 (0.52) ITGB3ITGB1ITGAVITGA5ITGB2
SCHEMBL12832351 0.74 THRB (0.77) TGM2THRATHRBF13A1TGM1
Trifluoroacetic Acid SCHEMBL7859231 0.74 TAAR1 (0.67) —
Tyramine SCHEMBL6433562 0.74 TAAR1 (0.67) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2475375-A2 PI3 KINASE INHIBITORS AND USES THEREOF Avila Therapeutics, Inc. (US) 2012-07-18 — — EP disclosed
US-20110230476-A1 PI3 KINASE INHIBITORS AND USES THEREOF AVILA THERAPEUTICS, INC. (US) 2011-09-22 — — US disclosed
WO-2011031896-A2 PI3 KINASE INHIBITORS AND USES THEREOF AVILA THERAPEUTICS, INC. (US) 2011-03-17 — — WO 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-20110230476-A1 PI3 KINASE INHIBITORS AND USES THEREOF PIK3CA, PIK3CB, PIK3C2B TGM2 2927/4885THRA 3800/4885THRB 2282/4885

“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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