Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL4878633

C=Cc1c(C)nc2c(O)cc(-n3ccccc3=O)cn12.O=C(O)C(F)(F)F

nearest known ligand 0.43

Full drug profile on Sugi Atlas →

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 12/20 0.43
CYP2C9 P11712 12/20 0.43
CYP1A2 P05177 1/20 0.39
CYP2D6 P10635 1/20 0.39
KDM4E B2RXH2 1/20 0.32
ALDH1A1 P00352 1/20 0.32
LMNA P02545 1/20 0.32
GLA P06280 1/20 0.32
GAA P10253 1/20 0.32
MPI P34949 1/20 0.32
SCD O00767 2/20 0.32
MCHR1 Q99705 1/20 0.31

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
SCHEMBL14021275 0.92 CYP3A4 (0.46) CYP3A4CYP2C9CYP1A2CYP2D6KDM4E
SCHEMBL4878638 0.83 CYP3A4 (0.46) CYP3A4CYP2C9CYP1A2CYP2D6
Trifluoroacetic Acid SCHEMBL4888748 0.79 CYP3A4 (0.40) CYP3A4CYP2C9CYP1A2CYP2D6KDM4E
SCHEMBL4881228 0.77 CYP3A4 (0.61) CYP3A4CYP2C9CYP1A2CYP2D6KDM4E
SCHEMBL4885850 0.71 CYP3A4 (0.77) CYP3A4CYP2C9CYP1A2CYP2D6MCHR1
SCHEMBL4888544 0.69 CYP3A4 (0.55) CYP3A4CYP2C9CYP1A2CYP2D6LMNA
SCHEMBL14021269 0.69 CYP3A4 (0.44) CYP3A4CYP2C9CYP1A2CYP2D6KDM4E
SCHEMBL4881063 0.64 CYP3A4 (0.65) CYP3A4CYP2C9CYP1A2CYP2D6MCHR1
SCHEMBL4890938 0.64 CYP3A4 (0.61) CYP3A4CYP2C9CYP1A2CYP2D6MCHR1
SCHEMBL4888752 0.63 CYP3A4 (0.42) CYP3A4CYP2C9CYP1A2CYP2D6ALDH1A1

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-20080255358-A1 Derivatives of Imidazo [1,2-A] Pyridine Useful as Medicaments For Treating Gastrointestinal Diseases GLAXO GROUP LIMITED (GB) 2008-10-16 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-20080255358-A1 Derivatives of Imidazo [1,2-A] Pyridine Useful as Medicaments For Treating Gastrointestinal Diseases ALPI, PYGL, PPIP5K2 CYP3A4 215/4885CYP2C9 1357/4885CYP1A2 149/4885

“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.