Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL3219974

O=C(N[C@@H]1CCC[C@H](c2nc3ccccc3[nH]2)C1)c1ccc2nonc2c1.O=C(O)C(F)(F)F

nearest known ligand 0.67

Full drug profile on Sugi Atlas →

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 1/20 0.47
TAS1R3 Q7RTX0 1/20 0.43
TAS1R1 Q7RTX1 1/20 0.43
TAS1R2 Q8TE23 1/20 0.43
HTR2B P41595 4/20 0.42
CHEK1 O14757 1/20 0.41
CXCR6 O00574 1/20 0.41
PAX8 Q06710 1/20 0.41
GID4 Q8IVV7 2/20 0.40
SMN1; SMN2 Q16637 1/20 0.39
ADORA3 P0DMS8 1/20 0.39
ADORA2A P29274 1/20 0.39
ADORA2B P29275 1/20 0.39
ADORA1 P30542 1/20 0.39

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
SCHEMBL13490684 0.94 EPHX2 (0.50) EPHX2TAS1R3TAS1R1TAS1R2HTR2B
Trifluoroacetic Acid SCHEMBL3216470 0.90 HTR2B (0.43) HTR2BCHEK1CXCR6PAX8GID4
Trifluoroacetic Acid SCHEMBL3210512 0.90 HTR2B (0.43) HTR2BCHEK1CXCR6GID4SMN1; SMN2
Trifluoroacetic Acid SCHEMBL3218339 0.88 CXCR6 (0.42) HTR2BCHEK1CXCR6PAX8GID4
Trifluoroacetic Acid SCHEMBL3222284 0.87 RAB9A (0.48) HTR2BCHEK1SMN1; SMN2
Trifluoroacetic Acid SCHEMBL3202683 0.87 RAB9A (0.48) TAS1R3TAS1R1SMN1; SMN2
Trifluoroacetic Acid SCHEMBL3223330 0.87 SMYD3 (0.44) HTR2BCHEK1CXCR6GID4SMN1; SMN2
Trifluoroacetic Acid SCHEMBL3221433 0.87 SMYD3 (0.44) HTR2BCHEK1CXCR6GID4SMN1; SMN2
Trifluoroacetic Acid SCHEMBL3223613 0.86 FOXO1 (0.45) HTR2BCHEK1CXCR6PAX8
Trifluoroacetic Acid SCHEMBL3222205 0.86 MLLT1 (0.54) HTR2BCHEK1CXCR6

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-20100029615-A1 BENZIMIDAZOLE DERIVATIVES PFIZER INC. 2010-02-04 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-20100029615-A1 BENZIMIDAZOLE DERIVATIVES ACIN1, HAT1, CCNE1 EPHX2 4250/4885TAS1R3 234/4885TAS1R1 305/4885

“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.