Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL710853

CC(C)=CCOc1cc(OCc2ccccc2)cc(-c2nc3cccnc3[nH]2)c1.O=C(O)C(F)(F)F

nearest known ligand 0.40

Full drug profile on Sugi Atlas →

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PPARG P37231 1/20 0.39
CHEK2 O96017 1/20 0.39
NOS1 P29475 2/20 0.38
MAOA P21397 1/20 0.37
MAOB P27338 1/20 0.37
PRMT5 O14744 4/20 0.37
CYP3A4 P08684 1/20 0.37
SCD O00767 1/20 0.36
DHODH Q02127 3/20 0.36
NOS3 P29474 1/20 0.36
SYK P43405 1/20 0.35

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
SCHEMBL10206647 0.93 CYP3A4 (0.42) PPARGCHEK2MAOAMAOBPRMT5
Trifluoroacetic Acid SCHEMBL712377 0.91 CHEK2 (0.45) CHEK2PRMT5CYP3A4SCDDHODH
Trifluoroacetic Acid SCHEMBL711040 0.87 DHODH (0.45) CHEK2PRMT5DHODH
Trifluoroacetic Acid SCHEMBL713011 0.86 GCK (0.44) CHEK2NOS1PRMT5SCDDHODH
Trifluoroacetic Acid SCHEMBL712661 0.86 CHEK2 (0.41) CHEK2PRMT5CYP3A4SCDDHODH
Trifluoroacetic Acid SCHEMBL710265 0.86 MAOB (0.39) PPARGCHEK2MAOAMAOBCYP3A4
Trifluoroacetic Acid SCHEMBL711105 0.84 CYP1A1 (0.41) CHEK2PRMT5SCDDHODH
Trifluoroacetic Acid SCHEMBL711953 0.83 CHEK2 (0.40) CHEK2PRMT5SCDDHODH
Trifluoroacetic Acid SCHEMBL709196 0.83 FFAR1 (0.42) CHEK2PRMT5CYP3A4DHODH
SCHEMBL10206641 0.82 PRMT5 (0.51) CHEK2PRMT5CYP3A4DHODH

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 PPARG 991/4885CHEK2 1189/4885NOS1 3126/4885

“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.