Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL21491685

NCc1cnn(Cc2ccc(C(F)(F)F)nc2Cl)c1.O=C(O)C(F)(F)F

nearest known ligand 0.38

Full drug profile on Sugi Atlas →

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 1/20 0.38
KDM4E B2RXH2 1/20 0.36
ALDH1A1 P00352 1/20 0.36
KLKB1 P03952 10/20 0.35
POLB P06746 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
TRPV1 Q8NER1 1/20 0.33
ITGB3 P05106 1/20 0.33
ITGB1 P05556 1/20 0.33
ITGAV P06756 1/20 0.33
ITGA5 P08648 1/20 0.33
LOXL2 Q9Y4K0 1/20 0.33
SCD5 Q86SK9 2/20 0.32
ERCC5 P28715 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
SCHEMBL30057783 0.92 MAPT (0.33) HSD17B10KDM4EALDH1A1KLKB1L3MBTL1
SCHEMBL21503568 0.92 MAPT (0.33) HSD17B10KDM4EALDH1A1KLKB1L3MBTL1
SCHEMBL21503393 0.82 KLKB1 (0.35) KDM4EALDH1A1KLKB1SCD5
Trifluoroacetic Acid SCHEMBL28524316 0.82 SCD5 (0.40) KDM4EALDH1A1TRPV1SCD5
Hydrochloric Acid SCHEMBL21491586 0.81 KLKB1 (0.35) KDM4EALDH1A1KLKB1LOXL2SCD5
Hydrochloric Acid SCHEMBL30744393 0.81 KLKB1 (0.35) KDM4EALDH1A1KLKB1LOXL2SCD5
SCHEMBL30744336 0.78 SCD5 (0.35) KLKB1LOXL2SCD5
SCHEMBL21492743 0.78 SCD5 (0.35) KLKB1LOXL2SCD5
Hydrochloric Acid SCHEMBL21492863 0.77 KLKB1 (0.36) ALDH1A1KLKB1L3MBTL1LOXL2
Hydrochloric Acid SCHEMBL30744383 0.77 KLKB1 (0.36) ALDH1A1KLKB1L3MBTL1LOXL2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3784669-B1 PTERIDINONE COMPOUNDS AND USES THEREOF VERTEX PHARMA (US) 2023-10-25 EP disclosed
US-20230312587-A1 PTERIDINONE COMPOUNDS AND USES THEREOF VERTEX PHARMACEUTICALS INCORPORATED 2023-10-05 US disclosed
US-11059826-B2 Pteridinone compounds and uses thereof VERTEX PHARMACEUTICALS INCORPORATED (US) 2021-07-13 US disclosed
EP-3784669-A1 PTERIDINONE COMPOUNDS AND USES THEREOF Vertex Pharmaceuticals Incorporated (US) 2021-03-03 EP disclosed
US-20190322673-A1 PTERIDINONE COMPOUNDS AND USES THEREOF VERTEX PHARMACEUTICALS INCORPORATED 2019-10-24 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 (3 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-20190322673-A1 PTERIDINONE COMPOUNDS AND USES THEREOF DPYD, PKD1, TYMP HSD17B10 1245/4885KDM4E 730/4885ALDH1A1 569/4885
US-11059826-B2 Pteridinone compounds and uses thereof DPYD, PKD1, TYMP HSD17B10 1245/4885KDM4E 730/4885ALDH1A1 569/4885
US-20230312587-A1 PTERIDINONE COMPOUNDS AND USES THEREOF DPYD, PKD1, TYMP HSD17B10 1245/4885KDM4E 730/4885ALDH1A1 569/4885

“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.