Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL4840418

CCN1CCCC(NCCOc2ccc(-c3nc4cc(Br)cnc4[nH]3)cc2)C1.O=C(O)C(F)(F)F.O=C(O)C(F)(F)F

nearest known ligand 0.39

Full drug profile on Sugi Atlas →

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TBK1 Q9UHD2 5/20 0.39
IKBKE Q14164 4/20 0.38
ALDH1A1 P00352 3/20 0.38
CDK2 P24941 1/20 0.37
AURKB Q96GD4 1/20 0.37
CHEK2 O96017 8/20 0.37
KDM4E B2RXH2 2/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
NLRP3 Q96P20 1/20 0.36
ACHE P22303 2/20 0.36

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
SCHEMBL4840752 0.93 TBK1 (0.44) TBK1IKBKECDK2AURKBKDM4E
Trifluoroacetic Acid SCHEMBL4845728 0.89 LMNA (0.40) ALDH1A1CHEK2KDM4EMEN1KMT2A
Trifluoroacetic Acid SCHEMBL4844409 0.88 ALDH1A1 (0.46) TBK1ALDH1A1AURKBCHEK2KDM4E
Trifluoroacetic Acid SCHEMBL4839422 0.84 KDM4E (0.43) ALDH1A1CHEK2KDM4EMEN1KMT2A
Trifluoroacetic Acid SCHEMBL4843340 0.84 CHEK2 (0.40) ALDH1A1CHEK2KDM4EMEN1KMT2A
Trifluoroacetic Acid SCHEMBL4843958 0.83 CHEK2 (0.44) TBK1IKBKEALDH1A1CDK2AURKB
Trifluoroacetic Acid SCHEMBL4842116 0.83 CHEK2 (0.53) TBK1IKBKECDK2AURKBCHEK2
SCHEMBL4842267 0.82 CYP3A4 (0.43) TBK1ALDH1A1MEN1KMT2A
Trifluoroacetic Acid SCHEMBL4835045 0.81 CHEK2 (0.46) TBK1IKBKECDK2AURKBCHEK2
Trifluoroacetic Acid SCHEMBL4837609 0.81 TRPV3 (0.39) TBK1ALDH1A1AURKBCHEK2

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
US-7410966-B2 Use of and some novel imidazopyridines ASTRAZENECA AB (SE) 2008-08-12 US disclosed
EP-1539759-B1 NOVEL IMIDAZOPYRIDINES AND THEIR USE ASTRAZENECA AB (SE) 2007-08-15 EP disclosed
US-20050261333-A1 Use of and some novel imidazopyridines ASTRAZENECA A B (SE) 2005-11-24 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-20050261333-A1 Use of and some novel imidazopyridines ITK, CSNK1A1, RPS6KA1 TBK1 1029/4885IKBKE 95/4885ALDH1A1 1489/4885

“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.