Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL2933159

CCN(CC)CCNC(=O)c1ccc(Nc2cncc(-c3cc4cc(F)ccc4[nH]3)n2)c(Cl)c1.O=C(O)C(F)(F)F

nearest known ligand 0.38

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.38
POLB P06746 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.36
CCNT1 O60563 1/20 0.36
CCNA2 P20248 1/20 0.36
CDK2 P24941 1/20 0.36
CDK9 P50750 1/20 0.36
CCNA1 P78396 1/20 0.36
KDR P35968 1/20 0.36
EGFR P00533 2/20 0.35
ERBB2 P04626 2/20 0.35
HDAC3 O15379 1/20 0.35
HDAC4 P56524 1/20 0.35
HDAC1 Q13547 1/20 0.35
HDAC7 Q8WUI4 1/20 0.35
HDAC2 Q92769 1/20 0.35
HDAC10 Q969S8 1/20 0.35
HDAC11 Q96DB2 1/20 0.35
HDAC8 Q9BY41 1/20 0.35
HDAC6 Q9UBN7 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
SCHEMBL2931629 0.96 MAPT (0.40) MAPTPOLBL3MBTL1CCNT1CCNA2
Trifluoroacetic Acid SCHEMBL2960848 0.90 TMEM97 (0.40) MAPTPOLBL3MBTL1CCNT1CCNA2
SCHEMBL2930653 0.85 TMEM97 (0.43) MAPTPOLBL3MBTL1CCNT1CCNA2
SCHEMBL2933161 0.83 SYK (0.33) CCNA2CDK2CNR1
Trifluoroacetic Acid SCHEMBL2931064 0.82 TMEM97 (0.41) MAPTCYP3A4CYP2C9TP53ALDH1A1
SCHEMBL2928690 0.81 AURKA (0.47) CCNA2CDK2KDM4ELMNAALDH1A1
Trifluoroacetic Acid SCHEMBL2930403 0.78 CDK2 (0.41) L3MBTL1CCNA2CDK2KDR
Trifluoroacetic Acid SCHEMBL2930092 0.76 HDAC4 (0.44) KDRHDAC3HDAC4HDAC1HDAC7
Trifluoroacetic Acid SCHEMBL2928643 0.76 PTK2 (0.39) CCNA2CDK2ALDH1A1TSHR
SCHEMBL2931747 0.76 TMEM97 (0.45) MAPTCCNA2CDK2CYP3A4CYP2C9

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
EP-2044051-B1 PYRIDINE AND PYRAZINE DERIVATIVES AS MNK KINASE INHIBITORS BIOVITRUM AB PUBL (SE) 2010-01-27 EP disclosed
US-20080039450-A1 Compounds BIOVITRUM AB (PUBL.) (SE) 2008-02-14 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-20080039450-A1 Compounds NEK2, CSNK2A3, CSNK2A1 MAPT 1652/4885POLB 1721/4885L3MBTL1 3556/4885

“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.