Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL4929908

Cc1nc(C(=O)N2CCN(C)CC2)cc2c(Nc3cccc4c3CCO4)c(C(N)=O)cnc12.Cc1nc(C(N)=O)cc2c(Nc3cccc4c3CCO4)c(C(=O)NC3CCC3)cnc12.O=C(O)C(F)(F)F

nearest known ligand 0.42

Full drug profile on Sugi Atlas →

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 1/20 0.42
BMPR1B O00238 1/20 0.34
BMPR1A P36894 1/20 0.34
TGFBR1 P36897 1/20 0.34
ACVRL1 P37023 1/20 0.34
ACVR1 Q04771 1/20 0.34
CXCR2 P25025 2/20 0.34
CSF1R P07333 3/20 0.34
MAP4K1 Q92918 1/20 0.33
DRD2 P14416 4/20 0.33
HTR2A P28223 4/20 0.33
DRD3 P35462 4/20 0.33
PTK2 Q05397 3/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2C9 P11712 1/20 0.33
KCNH2 Q12809 1/20 0.32
JAK3 P52333 1/20 0.32
TTK P33981 1/20 0.32
TYK2 P29597 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
Trifluoroacetic Acid SCHEMBL4920764 0.92 PDE4B (0.49) PDE4BCXCR2CSF1RMAP4K1CYP3A4
Trifluoroacetic Acid SCHEMBL4929066 0.87 PDE4B (0.41) PDE4BMAP4K1DRD2HTR2ADRD3
Trifluoroacetic Acid SCHEMBL4926823 0.84 PDE4B (0.46) PDE4BMAP4K1DRD2HTR2ADRD3
SCHEMBL4928787 0.83 PDE4B (0.55) PDE4BCSF1RCYP3A4CYP2C9
Trifluoroacetic Acid SCHEMBL4930138 0.82 PDE4B (0.45) PDE4BCYP3A4CYP2C9JAK3TYK2
SCHEMBL4928653 0.82 PDE4B (0.54) PDE4BCSF1RCYP3A4CYP2C9
Trifluoroacetic Acid SCHEMBL4924460 0.81 PDE4B (0.44) PDE4B
SCHEMBL4928496 0.81 PDE4B (0.54) PDE4BCSF1RCYP3A4CYP2C9KCNH2
Trifluoroacetic Acid SCHEMBL4925209 0.81 PDE4B (0.46) PDE4BCSF1RPTK2CYP3A4CYP2C9
SCHEMBL4923595 0.80 PDE4B (0.53) PDE4BCSF1RCYP3A4CYP2C9KCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080146563-A1 1,7-Naphthyridines as Pde4 Inhibitors GLAXO GROUP LIMITED 2008-06-19 US claimed
US-20080146563-A1 1,7-Naphthyridines as Pde4 Inhibitors GLAXO GROUP LIMITED 2008-06-19 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-20080146563-A1 1,7-Naphthyridines as Pde4 Inhibitors PDE4A, PDE3B, PDE4B PDE4B 3/4885BMPR1B 1603/4885BMPR1A 1584/4885

“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.