Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL4134744

CCN(CC)C(=O)Nc1c[nH]nc1-c1nc2cc(OCCCCN3CCCCC3)c(F)cc2[nH]1.O=C(O)C(F)(F)F

nearest known ligand 0.49

Full drug profile on Sugi Atlas →

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SYK P43405 1/20 0.49
ITK Q08881 1/20 0.49
CHEK2 O96017 2/20 0.35
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
FGFR1 P11362 1/20 0.34
FLT1 P17948 1/20 0.34
KDM4E B2RXH2 2/20 0.33
L3MBTL1 Q9Y468 2/20 0.33
ALDH1A1 P00352 1/20 0.33
HRH4 Q9H3N8 1/20 0.32
DHODH Q02127 1/20 0.32
MET P08581 4/20 0.32
EHMT2 Q96KQ7 2/20 0.32
EHMT1 Q9H9B1 1/20 0.32
EGLN1 Q9GZT9 1/20 0.32

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
SCHEMBL4133840 0.96 SYK (0.53) SYKITKCHEK2MEN1KMT2A
Trifluoroacetic Acid SCHEMBL4129766 0.93 SYK (0.46) SYKITKCHEK2KDM4EALDH1A1
SCHEMBL4142555 0.91 SYK (0.49) SYKITKCHEK2FGFR1FLT1
Hydrochloric Acid SCHEMBL4134722 0.90 SYK (0.49) SYKITKCHEK2FGFR1FLT1
Trifluoroacetic Acid SCHEMBL4122410 0.89 CHEK2 (0.36) SYKITKCHEK2MEN1KMT2A
SCHEMBL4133817 0.88 SYK (0.50) SYKITKCHEK2FGFR1FLT1
SCHEMBL3924905 0.84 CHEK2 (0.39) SYKITKCHEK2MEN1KMT2A
Trifluoroacetic Acid SCHEMBL4134146 0.83 SYK (0.49) SYKITKCHEK2KDM4EHRH4
Trifluoroacetic Acid SCHEMBL4130010 0.80 SYK (0.43) SYKITKMEN1KMT2AFGFR1
SCHEMBL3934547 0.79 ITK (0.46) SYKITKCHEK2FGFR1FLT1

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-9126969-B2 Pyrazolylbenzimidazole derivatives, compositions containing them and use thereof AVENTIS PHARMA S.A. (FR) 2015-09-08 US disclosed
US-20090197866-A1 PYRAZOLYLBENZIMIDAZOLE DERIVATIVES, COMPOSITIONS CONTAINING THEM AND USE THEREOF AVENTIS PHARMA S.A. (FR) 2009-08-06 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-20090197866-A1 PYRAZOLYLBENZIMIDAZOLE DERIVATIVES, COMPOSITIONS CONTAINING THEM AND USE THEREOF RB1, CCNI, CDK2 SYK 392/4885ITK 1817/4885CHEK2 13/4885

“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.