Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL711170

CC(C)Oc1ccc(OCCC2CCCCC2)cc1-c1nc2cccnc2[nH]1.O=C(O)C(F)(F)F

nearest known ligand 0.39

Full drug profile on Sugi Atlas →

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 1/20 0.39
PPARD Q03181 1/20 0.39
GCK P35557 3/20 0.39
ALOX5 P09917 2/20 0.38
PTGES O14684 1/20 0.38
MMP13 P45452 1/20 0.37
LDLR P01130 1/20 0.36
HPGD P15428 2/20 0.36
HCRTR1 O43613 1/20 0.35
HCRTR2 O43614 1/20 0.35
KIT P10721 1/20 0.35
PDGFRA P16234 1/20 0.35
PDGFRB P09619 1/20 0.35
P2RX3 P56373 2/20 0.34
PDE3B Q13370 1/20 0.34
PDE3A Q14432 1/20 0.34
LNPEP Q9UIQ6 3/20 0.34

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 SCHEMBL712854 0.94 GCK (0.39) FFAR1PPARDGCKALOX5PTGES
SCHEMBL9071888 0.93 HPGD (0.38) FFAR1PPARDGCKALOX5PTGES
SCHEMBL2668267 0.86 HPGD (0.38) GCKALOX5PTGESMMP13LDLR
Trifluoroacetic Acid SCHEMBL713667 0.86 GCK (0.47) GCKMMP13
Trifluoroacetic Acid SCHEMBL711385 0.84 CYP3A4 (0.39) PPARDMMP13HPGD
Trifluoroacetic Acid SCHEMBL713550 0.82 RUNX1 (0.46) HPGDPDGFRAPDGFRB
Trifluoroacetic Acid SCHEMBL708957 0.82 MAOB (0.36) PPARDALOX5
Trifluoroacetic Acid SCHEMBL711107 0.82 GPR132 (0.43) PPARDALOX5MMP13
Trifluoroacetic Acid SCHEMBL712435 0.81 SMO (0.40) GCK
Trifluoroacetic Acid SCHEMBL710214 0.79 PDE4A (0.40) GCKPTGESMMP13

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 FFAR1 3394/4885PPARD 866/4885GCK 1/4885

“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.