Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL710679

CC(C)Oc1cc(OCCN2CCCCC2)cc(-c2nc3cccnc3[nH]2)c1.O=C(O)C(F)(F)F.O=C(O)C(F)(F)F

nearest known ligand 0.44

Full drug profile on Sugi Atlas →

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ACHE P22303 6/20 0.44
CHEK2 O96017 2/20 0.42
DRD2 P14416 3/20 0.41
DRD3 P35462 3/20 0.41
ADORA2A P29274 2/20 0.40
ADORA1 P30542 2/20 0.40
TBK1 Q9UHD2 1/20 0.39
LNPEP Q9UIQ6 1/20 0.39
CCNE2 O96020 1/20 0.39
CCNE1 P24864 1/20 0.39
CDK2 P24941 1/20 0.39
GSK3B P49841 1/20 0.39
PARP1 P09874 1/20 0.39
DHODH Q02127 1/20 0.39
CLK2 P49760 1/20 0.38
CLK3 P49761 1/20 0.38
DYRK1A Q13627 1/20 0.38
AVPR1B P47901 1/20 0.38

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 SCHEMBL712076 0.92 RUNX1 (0.43) ACHEDRD2DRD3ADORA2AADORA1
SCHEMBL10206662 0.92 ACHE (0.51) ACHECHEK2DRD2DRD3ADORA2A
Trifluoroacetic Acid SCHEMBL709857 0.92 DRD3 (0.44) DRD2DRD3
Trifluoroacetic Acid SCHEMBL713667 0.86 GCK (0.47) CHEK2DHODH
SCHEMBL10206663 0.85 DRD3 (0.49) DRD2DRD3
Trifluoroacetic Acid SCHEMBL720615 0.84 GCK (0.45)
SCHEMBL10206661 0.83 ACHE (0.49) ACHEADORA2AADORA1TBK1
Trifluoroacetic Acid SCHEMBL713011 0.82 GCK (0.44) CHEK2DHODH
Trifluoroacetic Acid SCHEMBL709188 0.81 GCK (0.39) CHEK2DHODH
Trifluoroacetic Acid SCHEMBL709569 0.80 DHODH (0.43) DHODH

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-1940837-B1 IMIDAZOPYRIDINE COMPOUNDS TAKEDA PHARMACEUTICAL (JP) 2012-11-07 EP disclosed
US-8124617-B2 Imidazopyridine compounds TAKEDA SAN DIEGO, INC. (US) 2012-02-28 US disclosed
US-20100069431-A1 IMIDAZOPYRIDINE COMPOUNDS TAKEDA SAN DIEGO, INC. 2010-03-18 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-20100069431-A1 IMIDAZOPYRIDINE COMPOUNDS GCK, GCKR, KHK ACHE 790/4885CHEK2 1189/4885DRD2 3228/4885

“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.