Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL4262987

Cc1nc(N[C@H]2CC[C@@H](N)CC2)cc(N(C)C)n1.O=C(O)C(F)(F)F

nearest known ligand 0.41

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 10/20 0.41
ADRA2A P08913 3/20 0.41
HRH1 P35367 3/20 0.41
ADRA1A P35348 2/20 0.41
TPSAB1 Q15661 1/20 0.38
ROCK2 O75116 2/20 0.38
HRH4 Q9H3N8 2/20 0.37
HRH3 Q9Y5N1 2/20 0.37
PIM1 P11309 2/20 0.37
PIM2 Q9P1W9 2/20 0.37
KIT P10721 2/20 0.37
FLT3 P36888 2/20 0.37
AURKA O14965 1/20 0.37
EGFR P00533 1/20 0.37
NTRK1 P04629 1/20 0.37
CDK1 P06493 1/20 0.37
IGF1R P08069 1/20 0.37
EPHA1 P21709 1/20 0.37
CDK2 P24941 1/20 0.37
BMX P51813 1/20 0.37

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 SCHEMBL4262978 0.89 PDGFRB (0.44) MCHR1ADRA2AHRH1ADRA1AHRH4
SCHEMBL4262384 0.88 CDK2 (0.38) MCHR1ADRA2AHRH1ADRA1ACDK1
SCHEMBL4263812 0.88 CDK2 (0.38) MCHR1ADRA2AHRH1ADRA1ACDK1
SCHEMBL4262982 0.84 MCHR1 (0.47) MCHR1ADRA2AHRH1ADRA1AHTR2B
Trifluoroacetic Acid SCHEMBL4265548 0.82 MCHR1 (0.52) MCHR1ADRA2AHRH1ADRA1AHTR2B
SCHEMBL4258661 0.82 MCHR1 (0.46) MCHR1ADRA2AHRH1ADRA1AHTR2B
SCHEMBL4258666 0.82 MCHR1 (0.46) MCHR1ADRA2AHRH1ADRA1AHTR2B
Trifluoroacetic Acid SCHEMBL4255671 0.81 MCHR1 (0.67) MCHR1ADRA2AHRH1ADRA1AHTR2B
Trifluoroacetic Acid SCHEMBL4260895 0.81 MCHR1 (0.41) MCHR1ADRA2AHRH1ADRA1AHTR2B
Trifluoroacetic Acid SCHEMBL5670205 0.81 MCHR1 (0.41) MCHR1ADRA2AHRH1ADRA1AHTR2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090036448-A1 PYRIMIDINE DERIVATIVES AND METHODS OF TREATMENT RELATED TO THE USE THEREOF TAISHO PHARMECUTICAL CO., LTD. (JP) 2009-02-05 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 (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-20090036448-A1 PYRIMIDINE DERIVATIVES AND METHODS OF TREATMENT RELATED TO THE USE THEREOF GPR119, HCRTR2, MCHR1 MCHR1 3/4885ADRA2A 178/4885HRH1 363/4885

“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.