Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL709857

CC(=O)N1CCN(CCOc2cc(OC(C)C)cc(-c3nc4cccnc4[nH]3)c2)CC1.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 7)

geneUniProtsupporting neighboursconfidence
DRD3 P35462 12/20 0.44
DRD2 P14416 10/20 0.44
CYP4F2 P78329 1/20 0.42
CYP4A11 Q02928 1/20 0.42
KDR P35968 6/20 0.41
SRC P12931 5/20 0.41
GRM4 Q14833 1/20 0.39

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
SCHEMBL10206663 0.94 DRD3 (0.49) DRD3DRD2CYP4F2CYP4A11KDR
Trifluoroacetic Acid SCHEMBL710679 0.92 ACHE (0.44) DRD3DRD2
Trifluoroacetic Acid SCHEMBL712076 0.90 RUNX1 (0.43) DRD3DRD2GRM4
SCHEMBL10206662 0.83 ACHE (0.51) DRD3DRD2
Trifluoroacetic Acid SCHEMBL720615 0.82 GCK (0.45)
SCHEMBL10206661 0.81 ACHE (0.49) KDRSRC
Trifluoroacetic Acid SCHEMBL713667 0.81 GCK (0.47)
Trifluoroacetic Acid SCHEMBL713011 0.81 GCK (0.44)
Trifluoroacetic Acid SCHEMBL709188 0.79 GCK (0.39)
Trifluoroacetic Acid SCHEMBL709569 0.79 DHODH (0.43)

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-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
EP-1940837-A2 IMIDAZOPYRIDINE COMPOUNDS Takeda Pharmaceutical Company Limited (JP) 2008-07-09 EP disclosed
WO-2007028135-A2 IMIDAZOPYRIDINE COMPOUNDS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2007-03-08 WO 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 DRD3 3549/4885DRD2 3228/4885CYP4F2 750/4885

“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.