Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL3085583

C=CC(OC(=O)[C@@H](N)C(C)C)[C@H]1O[C@@H](n2cc(Br)c(=O)[nH]c2=O)C[C@@H]1Cl.O=C(O)C(F)(F)F

nearest known ligand 0.36

Full drug profile on Sugi Atlas →

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.32
ALDH1A1 P00352 1/20 0.32
POLB P06746 1/20 0.32
KMT2A Q03164 1/20 0.32
TYMS P04818 1/20 0.31
GRIA1 P42261 1/20 0.31
GRIA2 P42262 1/20 0.31
GRIA4 P48058 1/20 0.31
GRIK5 Q16478 1/20 0.31
LMNA P02545 1/20 0.30
ALOX12 P18054 1/20 0.30
ADRA1A P35348 1/20 0.30
TK1 P04183 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
Trifluoroacetic Acid SCHEMBL3089959 0.92
Trifluoroacetic Acid SCHEMBL3065214 0.84 RNASE1 (0.34) SMN1; SMN2ALDH1A1POLBKMT2ATYMS
SCHEMBL3082515 0.80 KMT2A (0.35) SMN1; SMN2ALDH1A1POLBKMT2A
Trifluoroacetic Acid SCHEMBL17135528 0.80 ABCG2 (0.36) POLBLMNATK1
SCHEMBL3078265 0.78 KMT2A (0.35) SMN1; SMN2ALDH1A1POLBKMT2A
Trifluoroacetic Acid SCHEMBL3072335 0.78 RNASE1 (0.31)
SCHEMBL3078293 0.77 TK2 (0.35) SMN1; SMN2ALDH1A1POLBKMT2A
SCHEMBL3066218 0.76 ALDH1A1 (0.39) SMN1; SMN2ALDH1A1POLBKMT2ATK1
Trifluoroacetic Acid SCHEMBL17135522 0.73 ABCG2 (0.30)
SCHEMBL3071139 0.73 SMN1; SMN2 (0.45) SMN1; SMN2ALDH1A1POLBKMT2ALMNA

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-2054406-B1 NUCLEOSIDES FOR SUPPRESSING OR REDUCING THE DEVELOPMENT OF RESISTANCE IN CYTOSTATIC THERAPY RESPROTECT GMBH (DE) 2015-10-07 EP disclosed
US-8492537-B2 Nucleosides for suppressing or reducing the development of resistance in cytostatic therapy RESPROTECT GMBH (DE) 2013-07-23 US disclosed
US-20100227834-A1 NUCLEOSIDES FOR SUPPRESSING OR REDUCING THE DEVELOPMENT OF RESISTANCE IN CYTOSTATIC THERAPY RESprotech GmbH (DE) 2010-09-09 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-20100227834-A1 NUCLEOSIDES FOR SUPPRESSING OR REDUCING THE DEVELOPMENT OF RESISTANCE IN CYTOSTATIC THERAPY TYMP, ENTPD5, NTPCR SMN1; SMN2 1379/4885ALDH1A1 1238/4885POLB 288/4885

“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.