Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL6792906

COc1ccc(/C=C/c2cc3c(cn2)CCc2c-3nn3c2C(=O)NCC3)cc1.O=C(O)C(F)(F)F

nearest known ligand 0.37

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPKAPK2 P49137 7/20 0.37
MAPT P10636 1/20 0.34
ALDH1A1 P00352 1/20 0.34
LMNA P02545 1/20 0.34
POLB P06746 1/20 0.34
GAA P10253 1/20 0.34
KDM4E B2RXH2 1/20 0.33
NPC1 O15118 1/20 0.33
PKM P14618 1/20 0.33
RAB9A P51151 1/20 0.33
CCNA2 P20248 3/20 0.33
CDK2 P24941 3/20 0.33
CCNA1 P78396 3/20 0.33
PLK1 P53350 2/20 0.33
AURKA O14965 2/20 0.33
KDM1A O60341 2/20 0.33
HDAC1 Q13547 1/20 0.32
HDAC6 Q9UBN7 1/20 0.32
CSNK1A1 P48729 1/20 0.32
CSNK1D P48730 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
Trifluoroacetic Acid SCHEMBL6792909 1.00 MAPKAPK2 (0.37) MAPKAPK2MAPTALDH1A1LMNAPOLB
SCHEMBL4267617 0.93 MAPKAPK2 (0.41) MAPKAPK2MAPTALDH1A1LMNAPOLB
SCHEMBL4267623 0.93 MAPKAPK2 (0.41) MAPKAPK2MAPTALDH1A1LMNAPOLB
Trifluoroacetic Acid SCHEMBL6794251 0.92 POLB (0.35) MAPKAPK2MAPTALDH1A1POLBGAA
Trifluoroacetic Acid SCHEMBL6794255 0.92 POLB (0.35) MAPKAPK2MAPTALDH1A1POLBGAA
Trifluoroacetic Acid SCHEMBL4255917 0.91 MAPKAPK2 (0.30) MAPKAPK2CDK2PLK1AURKACSNK1A1
Trifluoroacetic Acid SCHEMBL4255911 0.91 MAPKAPK2 (0.30) MAPKAPK2CDK2PLK1AURKACSNK1A1
Trifluoroacetic Acid SCHEMBL4256994 0.91 MAPKAPK2 (0.36) MAPKAPK2CCNA2CDK2CCNA1PLK1
Trifluoroacetic Acid SCHEMBL4256992 0.91 MAPKAPK2 (0.36) MAPKAPK2CCNA2CDK2CCNA1PLK1
SCHEMBL4255914 0.89

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040127492-A1 Cyclic pyrazoles for the inhibition of mitogen activated protein kinase-activated protein kinase-2 PHARMACIA CORPORATION 2004-07-01 US claimed

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-20040127492-A1 Cyclic pyrazoles for the inhibition of mitogen activated protein kinase-activated protein kinase-2 MKNK2, MAPKAPK2, MAP3K2 MAPKAPK2 2/4885MAPT 3143/4885ALDH1A1 4449/4885

“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.