Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL4691346

Cn1ccc2c3c(N)nc(N)nc3cc(-c3cc(Cl)cc(Cl)c3)c21.O=C(O)C(F)(F)F

nearest known ligand 0.41

Full drug profile on Sugi Atlas →

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
DHFR P00374 3/20 0.41
MET P08581 1/20 0.35
SLC2A1 P11166 5/20 0.35
AKR1C3 P42330 1/20 0.33
AKR1C2 P52895 1/20 0.33
PAX8 Q06710 1/20 0.33
F2R P25116 3/20 0.32
C1S P09871 1/20 0.32
MAP4K4 O95819 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
Trifluoroacetic Acid SCHEMBL4693908 0.92 DHFR (0.41) DHFRMETSLC2A1MAP4K4
Trifluoroacetic Acid SCHEMBL4692005 0.92 MAP4K4 (0.41) DHFRMETSLC2A1C1SMAP4K4
SCHEMBL4688000 0.90 DHFR (0.50) DHFRSLC2A1F2RMAP4K4
Trifluoroacetic Acid SCHEMBL4692099 0.89 DHFR (0.39) DHFRMETSLC2A1F2R
Trifluoroacetic Acid SCHEMBL4688622 0.89 DHFR (0.40) DHFRSLC2A1AKR1C3AKR1C2F2R
Trifluoroacetic Acid SCHEMBL4688071 0.87 DHFR (0.42) DHFRSLC2A1F2R
Trifluoroacetic Acid SCHEMBL4692244 0.87 DHFR (0.42) DHFRSLC2A1PAX8
Trifluoroacetic Acid SCHEMBL4689027 0.87 DHFR (0.42) DHFRMETSLC2A1PAX8
Trifluoroacetic Acid SCHEMBL4690263 0.87 DHFR (0.42) DHFRSLC2A1PAX8F2R
Trifluoroacetic Acid SCHEMBL4691132 0.87 DHFR (0.40) DHFRMETC1S

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 289/4885MET 3692/4885SLC2A1 271/4885
US-20070270445-A1 Diaminopyrroloquinazolines compounds as protein tyrosine phosphatase inhibitors PTPN5, DUSP15, PPP5C DHFR 339/4885MET 2593/4885SLC2A1 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.