Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL3179280

O=C(CNc1nc(-c2ccc(F)cc2)cs1)N1CCC1.O=C(O)C(F)(F)F

nearest known ligand 0.47

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MMP2 P08253 1/20 0.47
▸ MMP8 P22894 1/20 0.47
▸ LMNA P02545 4/20 0.47
▸ MAPK1 P28482 2/20 0.47
▸ KMT2A Q03164 6/20 0.47
▸ MEN1 O00255 5/20 0.45
▸ ALDH1A1 P00352 3/20 0.45
▸ L3MBTL1 Q9Y468 1/20 0.45
▸ RAB9A P51151 1/20 0.45
▸ MAPT P10636 2/20 0.45
▸ GAA P10253 2/20 0.45
▸ KDM4E B2RXH2 1/20 0.45
▸ HTT P42858 1/20 0.45
▸ SMN1; SMN2 Q16637 1/20 0.45
▸ TDP1 Q9NUW8 1/20 0.45
▸ MAOA P21397 3/20 0.45
▸ MAOB P27338 3/20 0.45
▸ POLB P06746 1/20 0.44
▸ HPGD P15428 1/20 0.43
▸ SLC12A2 P55011 1/20 0.43

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 SCHEMBL3171698 0.98 MMP2 (0.47) MMP2MMP8LMNAMAPK1KMT2A
Trifluoroacetic Acid SCHEMBL3173811 0.97 GAA (0.47) MMP2MMP8LMNAMAPK1KMT2A
SCHEMBL8452347 0.94 KMT2A (0.52) MMP2MMP8LMNAMAPK1KMT2A
SCHEMBL3179153 0.91 KMT2A (0.52) MMP2MMP8LMNAMAPK1KMT2A
SCHEMBL8459487 0.90 HPGD (0.53) MMP2MMP8LMNAMAPK1KMT2A
Trifluoroacetic Acid SCHEMBL3174446 0.84 LMNA (0.57) LMNAMAPK1KMT2AMEN1ALDH1A1
SCHEMBL6828220 0.82 KMT2A (0.47) MMP2MMP8LMNAMAPK1KMT2A
Trifluoroacetic Acid SCHEMBL3164230 0.80 KMT2A (0.49) LMNAMAPK1KMT2AMEN1ALDH1A1
Trifluoroacetic Acid SCHEMBL3173772 0.80 LMNA (0.57) LMNAMAPK1KMT2AMEN1ALDH1A1
SCHEMBL7988045 0.80 RAB9A (0.62) MAPK1KMT2AMEN1ALDH1A1RAB9A

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 MMP2 1675/4885MMP8 1290/4885LMNA 2141/4885

“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.

Send feedback