Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL3177298

O=C(CNc1nc(-c2ccc(F)cc2)cs1)NC1CC1.O=C(O)C(F)(F)F

nearest known ligand 0.52

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 7/20 0.52
▸ MAPK1 P28482 4/20 0.52
▸ POLB P06746 1/20 0.49
▸ KMT2A Q03164 5/20 0.49
▸ NPY5R Q15761 2/20 0.46
▸ MAPT P10636 4/20 0.46
▸ ALDH1A1 P00352 4/20 0.46
▸ MEN1 O00255 3/20 0.46
▸ RAB9A P51151 1/20 0.45
▸ HDAC1 Q13547 1/20 0.45
▸ HDAC6 Q9UBN7 1/20 0.45
▸ HDAC9 Q9UKV0 1/20 0.45
▸ SMN1; SMN2 Q16637 4/20 0.45
▸ HTT P42858 3/20 0.45
▸ KDM4E B2RXH2 2/20 0.45
▸ GAA P10253 2/20 0.45
▸ TDP1 Q9NUW8 2/20 0.45
▸ MMP2 P08253 1/20 0.45
▸ MMP8 P22894 1/20 0.45
▸ PRKACA P17612 1/20 0.44

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
SCHEMBL8446320 0.94 KMT2A (0.55) LMNAMAPK1POLBKMT2ANPY5R
Trifluoroacetic Acid SCHEMBL3174446 0.84 LMNA (0.57) LMNAMAPK1KMT2ANPY5RMAPT
Trifluoroacetic Acid SCHEMBL3173772 0.84 LMNA (0.57) LMNAMAPK1POLBKMT2AMAPT
Trifluoroacetic Acid SCHEMBL3173310 0.83 ALDH1A1 (0.57) LMNAMAPK1KMT2ANPY5RMAPT
Trifluoroacetic Acid SCHEMBL3170055 0.82 LMNA (0.64) LMNAMAPK1POLBKMT2ANPY5R
Trifluoroacetic Acid SCHEMBL3164230 0.80 KMT2A (0.49) LMNAMAPK1KMT2ANPY5RMAPT
Trifluoroacetic Acid SCHEMBL3169649 0.80 KMT2A (0.53) LMNAMAPK1KMT2AMAPTALDH1A1
Trifluoroacetic Acid SCHEMBL3179280 0.79 MMP2 (0.47) LMNAMAPK1POLBKMT2ANPY5R
Trifluoroacetic Acid SCHEMBL3171698 0.79 MMP2 (0.47) LMNAMAPK1POLBKMT2AMAPT
Trifluoroacetic Acid SCHEMBL3173811 0.78 GAA (0.47) LMNAMAPK1POLBKMT2AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8188291-B2 Heteroaryl-substituted carboxamides and their use as pharmaceuticals SANOFI-AVENTIS (FR) 2012-05-29 — — US disclosed
US-20100016337-A1 HETEROARYL-SUBSTITUTED CARBOXAMIDES AND THEIR USE AS PHARMACEUTICALS SANOFI-AVENTIS (FR) 2010-01-21 — — US disclosed
EP-2097382-A1 HETEROARYL-SUBSTITUTED CARBOXAMIDES AND USE THEREOF FOR THE STIMULATION OF THE EXPRESSION OF NO SYNTHASE Sanofi-Aventis (FR) 2009-09-09 — — EP disclosed
WO-2008077507-A1 HETEROARYL-SUBSTITUTED CARBOXAMIDES AND USE THEREOF FOR THE STIMULATION OF THE EXPRESSION OF NO SYNTHASE SANOFI-AVENTIS (FR) 2008-07-03 — — WO disclosed
EP-1939181-A1 Heteroaryl-substituted carboxamides and use thereof for the stimulation of the expression of NO synthase sanofi-aventis (FR) 2008-07-02 — — EP 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-20100016337-A1 HETEROARYL-SUBSTITUTED CARBOXAMIDES AND THEIR USE AS PHARMACEUTICALS TBXAS1, PTGIS, NOS2 LMNA 2141/4885MAPK1 2512/4885POLB 2912/4885

“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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