Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL4837229

COCCNCCOc1ccc(-c2nc3cc(Br)cnc3[nH]2)cc1.O=C(O)C(F)(F)F.O=C(O)C(F)(F)F

nearest known ligand 0.41

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.40
MEN1 O00255 1/20 0.40
ALDH1A1 P00352 1/20 0.40
KMT2A Q03164 1/20 0.40
HDAC6 Q9UBN7 13/20 0.40
HDAC3 O15379 11/20 0.39
HDAC4 P56524 11/20 0.39
HDAC1 Q13547 11/20 0.39
HDAC7 Q8WUI4 11/20 0.39
HDAC2 Q92769 11/20 0.39
HDAC10 Q969S8 11/20 0.39
HDAC11 Q96DB2 11/20 0.39
HDAC8 Q9BY41 11/20 0.39
HDAC9 Q9UKV0 11/20 0.39
HDAC5 Q9UQL6 11/20 0.39
BRD4 O60885 1/20 0.39
IKBKE Q14164 1/20 0.38
AURKB Q96GD4 1/20 0.38
TBK1 Q9UHD2 1/20 0.38
MAPT P10636 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
SCHEMBL4842957 0.91 JAK1 (0.40) KDM4EHDAC6HDAC3HDAC4HDAC1
Trifluoroacetic Acid SCHEMBL4844208 0.90 CYP3A4 (0.46) KDM4EALDH1A1
Trifluoroacetic Acid SCHEMBL4839525 0.89 HDAC6 (0.49) HDAC6HDAC3HDAC4HDAC1HDAC7
Trifluoroacetic Acid SCHEMBL4840737 0.89 HDAC6 (0.44) KDM4EHDAC6HDAC3HDAC4HDAC1
Trifluoroacetic Acid SCHEMBL5261300 0.88 KDM4E (0.42) KDM4EMEN1ALDH1A1KMT2AHDAC6
Trifluoroacetic Acid SCHEMBL4842803 0.87 KMT2A (0.45) KDM4EMEN1KMT2AHDAC6HDAC3
Trifluoroacetic Acid SCHEMBL4840800 0.87 CHEK2 (0.45) IKBKETBK1
Trifluoroacetic Acid SCHEMBL4842876 0.86 CHEK2 (0.45) KDM4EALDH1A1IKBKEAURKBTBK1
Trifluoroacetic Acid SCHEMBL4835096 0.86 TAAR1 (0.48) KMT2AHDAC6HDAC3HDAC4HDAC1
Trifluoroacetic Acid SCHEMBL4844131 0.86 HDAC6 (0.39) ALDH1A1KMT2AHDAC6HDAC3HDAC4

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-7410966-B2 Use of and some novel imidazopyridines ASTRAZENECA AB (SE) 2008-08-12 US 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 KDM4E 2903/4885MEN1 2592/4885ALDH1A1 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.