Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL4255596

Cc1nc(N[C@H]2CC[C@@H](CNC(=O)c3cc(C(F)(F)F)cc(C(F)(F)F)c3)CC2)cc(N(C)C)n1.O=C(O)C(F)(F)F

nearest known ligand 0.60

Full drug profile on Sugi Atlas →

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 13/20 0.60
ADRA2A P08913 5/20 0.60
ADRA1A P35348 3/20 0.60
HTR2B P41595 2/20 0.60
HTR1A P08908 1/20 0.60
HRH1 P35367 2/20 0.52
KCNH2 Q12809 2/20 0.44
CACNA1I Q9P0X4 1/20 0.44
NAPEPLD Q6IQ20 3/20 0.38
NPY5R Q15761 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
SCHEMBL4263655 0.96 MCHR1 (0.64) MCHR1ADRA2AADRA1AHTR2BHTR1A
SCHEMBL4263657 0.96 MCHR1 (0.64) MCHR1ADRA2AADRA1AHTR2BHTR1A
SCHEMBL4266250 0.89 MCHR1 (0.56) MCHR1ADRA2AADRA1AHTR2BHTR1A
SCHEMBL4266256 0.89 MCHR1 (0.56) MCHR1ADRA2AADRA1AHTR2BHTR1A
Trifluoroacetic Acid SCHEMBL4255671 0.88 MCHR1 (0.67) MCHR1ADRA2AADRA1AHTR2BHTR1A
SCHEMBL4260859 0.88 MCHR1 (0.66) MCHR1ADRA2AADRA1AHTR2BHTR1A
SCHEMBL4260861 0.88 MCHR1 (0.66) MCHR1ADRA2AADRA1AHTR2BHTR1A
Trifluoroacetic Acid SCHEMBL4267018 0.85 MCHR1 (0.55) MCHR1ADRA2AADRA1AHTR2BHTR1A
Trifluoroacetic Acid SCHEMBL4267015 0.85 MCHR1 (0.55) MCHR1ADRA2AADRA1AHTR2BHTR1A
SCHEMBL4263744 0.84 MCHR1 (0.72) MCHR1ADRA2AADRA1AHTR2BHTR1A

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 178/4885ADRA1A 271/4885

“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.