Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL3733116

Cc1cnccc1CN1C(=O)N(c2ccc(OC(F)(F)F)cc2)C(=O)C12CC2.O=C(O)C(F)(F)F

nearest known ligand 0.47

Full drug profile on Sugi Atlas →

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GCGR P47871 4/20 0.47
PPARD Q03181 5/20 0.38
PPARA Q07869 5/20 0.38
PPARG P37231 4/20 0.38
MCHR1 Q99705 7/20 0.37
CYP3A4 P08684 4/20 0.37
IGF1R P08069 1/20 0.35
KCNH2 Q12809 1/20 0.34
EGLN2 Q96KS0 1/20 0.34
EGLN1 Q9GZT9 1/20 0.34
EGLN3 Q9H6Z9 1/20 0.34

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
SCHEMBL2931386 0.95 GCGR (0.45) GCGRMCHR1CYP3A4IGF1RKCNH2
Trifluoroacetic Acid SCHEMBL2942467 0.90 GCGR (0.46) GCGRPPARDPPARAPPARGMCHR1
Trifluoroacetic Acid SCHEMBL2932719 0.89 PPARG (0.48) GCGRPPARDPPARAPPARGIGF1R
SCHEMBL2942195 0.86 GCGR (0.47) GCGRMCHR1CYP3A4IGF1R
Trifluoroacetic Acid SCHEMBL2935820 0.86 IGF1R (0.51) IGF1R
SCHEMBL2942291 0.85 GCGR (0.45) GCGRMCHR1CYP3A4IGF1RKCNH2
SCHEMBL2939915 0.85 GCGR (0.45) GCGRMCHR1CYP3A4IGF1RKCNH2
SCHEMBL2988142 0.85 GCGR (0.45) GCGRMCHR1CYP3A4IGF1RKCNH2
Trifluoroacetic Acid SCHEMBL3724563 0.85 IGF1R (0.49) GCGRPPARDPPARAPPARGMCHR1
SCHEMBL2939109 0.84 GCGR (0.44) GCGRMCHR1CYP3A4IGF1R

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-20170281641-A1 CYCLIC UREA COMPOUNDS AS TROPOMYOSIN-RELATED KINASE (TRK) iNHIBITORS GENZYME CORPORATION 2017-10-05 US disclosed
US-7825115-B2 Cyclic urea compounds, preparation thereof and pharmaceutical use thereof as kinase inhibitors AVENTIS PHARMA S.A. (FR) 2010-11-02 US disclosed
US-20080108654-A1 Cyclic Urea Compounds, Preparation Thereof and Pharmaceutical Use Thereof as Kinase Inhibitors AVENTIS PHARMA S.A. (FR) 2008-05-08 US disclosed
US-7354933-B2 Protein kinase inhibitors; antitumor agents; such as 5-methyl-1-quinol-4-ylmethyl-3-(4-trifluoromethanesulfonylphenyl)imidazolidine-2,4-dione trifluoroacetate AVENTIS PHARMA SA (FR) 2008-04-08 US disclosed
US-20040248884-A1 Novel cyclic urea derivatives, preparation thereof and pharmaceutical use thereof as kinase inhibitors AVENTIS PHARMA S.A. (FR) 2004-12-09 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 (3 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-20170281641-A1 CYCLIC UREA COMPOUNDS AS TROPOMYOSIN-RELATED KINASE (TRK) iNHIBITORS NGF, NTRK1, TK1 GCGR 2791/4885PPARD 3031/4885PPARA 3492/4885
US-20080108654-A1 Cyclic Urea Compounds, Preparation Thereof and Pharmaceutical Use Thereof as Kinase Inhibitors PRKG1, PRKACA, CMPK1 GCGR 2462/4885PPARD 3189/4885PPARA 4338/4885
US-20040248884-A1 Novel cyclic urea derivatives, preparation thereof and pharmaceutical use thereof as kinase inhibitors PRKG1, PRKACA, PRKCA GCGR 2407/4885PPARD 3572/4885PPARA 4692/4885

“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.