Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL3154236

CN(C)CC(=O)NC1CCC(C(N)=O)CC1.O=C(O)C(F)(F)F

nearest known ligand 0.39

Full drug profile on Sugi Atlas →

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MME P08473 2/20 0.39
TSHR P16473 1/20 0.39
MAOA P21397 1/20 0.38
F2 P00734 1/20 0.35
TMPRSS6 Q8IU80 1/20 0.35
BTK Q06187 2/20 0.34
KDM4E B2RXH2 1/20 0.34
MAPT P10636 1/20 0.33
DPP4 P27487 1/20 0.33
DPP8 Q6V1X1 1/20 0.33
FASN P49327 1/20 0.33
SELL P14151 1/20 0.33
SELP P16109 1/20 0.33
SELE P16581 1/20 0.33
CCR2 P41597 1/20 0.32
GAA P10253 1/20 0.32
EPHX1 P07099 1/20 0.32
MELK Q14680 1/20 0.32

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
SCHEMBL19502831 0.90 TSHR (0.41) MMETSHRMAOABTKKDM4E
Trifluoroacetic Acid SCHEMBL3154245 0.86 SMYD3 (0.42) MAOABTKDPP4DPP8CCR2
Trifluoroacetic Acid SCHEMBL3150139 0.81 MME (0.38) MMETSHR
SCHEMBL3154242 0.79 PKM (0.43) TSHRMAOAMAPTGAAEPHX1
SCHEMBL4191188 0.78 MAOA (0.47) MAOAMAPTGAAEPHX1
Trifluoroacetic Acid SCHEMBL4220312 0.77 KDM1A (0.43) MMETSHRKDM4EFASNEPHX1
Trifluoroacetic Acid SCHEMBL4446964 0.74 SMN1; SMN2 (0.39) TSHRKDM4EMAPTGAA
SCHEMBL16374937 0.74 SMYD3 (0.49) MAOAGAA
SCHEMBL21198215 0.74 SMYD3 (0.49) MAOAGAA
SCHEMBL21213732 0.74 SMYD3 (0.49) MAOAGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2012759-B1 PURINE DERIVATIVES AS A2A RECEPTOR AGONISTS NOVARTIS AG (CH) 2010-03-10 EP disclosed
US-20090093633-A1 Organic Compounds NOVARTIS AG 2009-04-09 US disclosed
EP-1841768-B1 PURINE DERIVATIVES ACTING AS A2A RECEPTOR AGONISTS NOVARTIS AG (CH) 2008-11-12 EP disclosed
US-20080207648-A1 Organic Compounds NOVARTIS AG (CH) 2008-08-28 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 (2 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-20090093633-A1 Organic Compounds ADORA2A, ADORA3, ADORA1 MME 3003/4885TSHR 230/4885MAOA 128/4885
US-20080207648-A1 Organic Compounds ADORA2A, ADORA1, ADORA3 MME 4578/4885TSHR 562/4885MAOA 369/4885

“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.