Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL3760442

Fc1ccc2c(c1)-n1cnnc1CNC2.O=C(O)C(F)(F)F

nearest known ligand 0.36

Full drug profile on Sugi Atlas →

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 1/20 0.34
CYP11B2 P19099 1/20 0.34
KDM1A O60341 1/20 0.32
DPP4 P27487 2/20 0.31
DPP9 Q86TI2 2/20 0.31
DPP7 Q9UHL4 2/20 0.31
KCNH2 Q12809 1/20 0.31
GABRG2 P18507 1/20 0.31
GABRB3 P28472 1/20 0.31
GABRA5 P31644 1/20 0.31
ALDH1A1 P00352 1/20 0.30

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
SCHEMBL14996183 0.89 CYP11B2 (0.38) CYP11B1CYP11B2
SCHEMBL14996185 0.79 CYP11B2 (0.38) CYP11B1CYP11B2
SCHEMBL8030555 0.73 CYP11B2 (0.41) CYP11B1CYP11B2
SCHEMBL8019235 0.72 GABRG2 (0.37) GABRG2GABRB3GABRA5ALDH1A1
SCHEMBL3760445 0.70 AVPR1A (0.32)
SCHEMBL2340498 0.70 AVPR1A (0.38) CYP11B1CYP11B2ALDH1A1
SCHEMBL8029367 0.68 ADRA1A (0.36) KCNH2
SCHEMBL3765031 0.68 ESR2 (0.41) DPP4DPP9DPP7
SCHEMBL13002479 0.67 KEAP1 (0.36) DPP4ALDH1A1
Trifluoroacetic Acid SCHEMBL21598479 0.67 ASIC3 (0.36) DPP4DPP9DPP7ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2250157-B1 NOVEL HETEROCYCLIC COMPOUNDS PANACEA BIOTEC LTD (IN) 2014-11-05 EP disclosed
US-8455479-B2 Heterocyclic compounds PANACEA BIOTEC LIMITED (IN) 2013-06-04 US disclosed
US-20100311732-A1 NOVEL HETEROCYCLIC COMPOUNDS PANACEA BIOTEC PHARMA LIMITED (IN) 2010-12-09 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 (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-20100311732-A1 NOVEL HETEROCYCLIC COMPOUNDS DPP4, DPP3, DPP8 CYP11B1 129/4885CYP11B2 164/4885KDM1A 3475/4885

“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.