Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL4688971

Cn1ccc2c3c(N)nc(N)nc3cc(-c3c(F)cccc3F)c21.O=C(O)C(F)(F)F

nearest known ligand 0.41

Full drug profile on Sugi Atlas →

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
DHFR P00374 5/20 0.41
PAX8 Q06710 1/20 0.36
SLC2A1 P11166 6/20 0.36
PRKD3 O94806 1/20 0.32
CLK2 P49760 1/20 0.32
DYRK1A Q13627 1/20 0.32
PRKD2 Q9BZL6 1/20 0.32
PIM2 Q9P1W9 1/20 0.32
KCNH2 Q12809 1/20 0.32
PDGFRB P09619 1/20 0.32
FGFR1 P11362 1/20 0.32
SRC P12931 1/20 0.32
PDGFRA P16234 1/20 0.32
ADORA2A P29274 1/20 0.32
ADORA1 P30542 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
SCHEMBL4688689 0.91 DHFR (0.49) DHFRSLC2A1KCNH2
Trifluoroacetic Acid SCHEMBL4694171 0.90 DHFR (0.41) DHFRPAX8SLC2A1PRKD3CLK2
Trifluoroacetic Acid SCHEMBL4688945 0.88 DCPS (0.41) DHFRPAX8SLC2A1KCNH2ADORA2A
Trifluoroacetic Acid SCHEMBL4689915 0.87 SLC2A1 (0.41) DHFRPAX8SLC2A1ADORA2A
Trifluoroacetic Acid SCHEMBL4692020 0.85 DHFR (0.41) DHFRPAX8SLC2A1
Trifluoroacetic Acid SCHEMBL4690346 0.85 DHFR (0.41) DHFRPAX8SLC2A1
Trifluoroacetic Acid SCHEMBL4687821 0.85 DHFR (0.41) DHFRPAX8SLC2A1
Trifluoroacetic Acid SCHEMBL4693910 0.85 DHFR (0.41) DHFRPAX8SLC2A1
Trifluoroacetic Acid SCHEMBL4692244 0.85 DHFR (0.42) DHFRPAX8SLC2A1ADORA2AADORA1
Trifluoroacetic Acid SCHEMBL4689027 0.85 DHFR (0.42) DHFRPAX8SLC2A1ADORA2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7262297-B2 Diaminopyrroloquinazolines compounds as protein tyrosine phosphatase inhibitors HOFFMANN-LA ROCHE INC. (US) 2007-08-28 US claimed
US-20040235872-A1 Diaminopyrroloquinazolines compounds as protein tyrosine phosphatase inhibitors BERTHEL STEVEN JOSEPH (US) 2004-11-25 US claimed
EP-1628979-B1 DIAMINOPYRROLOQUINAZOLINES COMPOUNDS AS PROTEIN TYROSINE PHOSPHATASE INHIBITORS HOFFMANN LA ROCHE (CH) 2008-03-19 EP disclosed
US-20070270445-A1 Diaminopyrroloquinazolines compounds as protein tyrosine phosphatase inhibitors BERTHEL STEVEN J 2007-11-22 US disclosed
US-7262297-B2 Diaminopyrroloquinazolines compounds as protein tyrosine phosphatase inhibitors HOFFMANN-LA ROCHE INC. (US) 2007-08-28 US disclosed
US-20040235872-A1 Diaminopyrroloquinazolines compounds as protein tyrosine phosphatase inhibitors BERTHEL STEVEN JOSEPH (US) 2004-11-25 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 (2 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-20040235872-A1 Diaminopyrroloquinazolines compounds as protein tyrosine phosphatase inhibitors PTPN5, PPP5C, PTP4A2 DHFR 289/4885PAX8 1715/4885SLC2A1 271/4885
US-20070270445-A1 Diaminopyrroloquinazolines compounds as protein tyrosine phosphatase inhibitors PTPN5, DUSP15, PPP5C DHFR 339/4885PAX8 2586/4885SLC2A1 298/4885

“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.