Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL3314501

Cc1ccc(C(=O)NC2CC2)cc1Nc1nc(-c2cccc(NC(=O)CCN)c2)c(C(=O)NCc2ccccc2)s1.O=C(O)C(F)(F)F.O=C(O)C(F)(F)F

nearest known ligand 0.42

Full drug profile on Sugi Atlas →

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 12/20 0.42
MAPK11 Q15759 8/20 0.42
LMNA P02545 2/20 0.39
MAPT P10636 3/20 0.38
KDM4E B2RXH2 1/20 0.38
HPGD P15428 1/20 0.38
PPARG P37231 1/20 0.38
KMT2A Q03164 1/20 0.38
NCOA2 Q15596 1/20 0.38
NCOA1 Q15788 1/20 0.38
TP53 P04637 1/20 0.37
SMYD3 Q9H7B4 1/20 0.37
MAPK13 O15264 2/20 0.37
MAPK12 P53778 2/20 0.37
POLB P06746 1/20 0.37
RXFP1 Q9HBX9 1/20 0.37
TPSAB1 Q15661 1/20 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
SCHEMBL13534496 0.96 MAPK14 (0.45) MAPK14MAPK11LMNAMAPTKDM4E
Trifluoroacetic Acid SCHEMBL3318068 0.95 MAPK14 (0.42) MAPK14MAPK11LMNAMAPTKDM4E
Trifluoroacetic Acid SCHEMBL3316710 0.94 MAPK14 (0.40) MAPK14MAPK11LMNAMAPTKDM4E
SCHEMBL13534495 0.91 MAPK14 (0.46) MAPK14MAPK11LMNAMAPTKDM4E
Trifluoroacetic Acid SCHEMBL3817968 0.90 MAPK14 (0.40) MAPK14MAPK11LMNASMYD3MAPK13
SCHEMBL3835446 0.89 MAPK14 (0.43) MAPK14MAPK11LMNAMAPTKDM4E
Trifluoroacetic Acid SCHEMBL3316074 0.89 MAPK14 (0.40) MAPK14MAPK11LMNAMAPTKDM4E
SCHEMBL3320357 0.88 MAPK14 (0.42) MAPK14MAPK11LMNAMAPTKDM4E
SCHEMBL3311987 0.86 MAPK14 (0.42) MAPK14MAPK11LMNAMAPTKDM4E
SCHEMBL3317676 0.86 MAPK14 (0.47) MAPK14MAPK11LMNAMAPTTP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7652044-B2 P-38 inhibitors NOVARTIS A.G. (CH) 2010-01-26 US claimed
US-20100004298-A1 P-38 INHIBITORS DONG QING 2010-01-07 US claimed
EP-1635824-B1 5-MEMBERED HETEROCYCLE-BASED P-38 INHIBITORS NOVARTIS AG (CH) 2009-08-19 EP claimed
EP-1635824-A2 5-MEMBERED HETEROCYCLE-BASED P-38 INHIBITORS Novartis AG (CH) 2006-03-22 EP claimed
WO-2005000298-A2 5-MEMBERED HETEROCYCLE-BASED P-38 INHIBITORS NOVARTIS AG (CH) 2005-01-06 WO claimed
US-20040254236-A1 P-38 inhibitors NOVARTIS AG (CH) 2004-12-16 US claimed
US-7652044-B2 P-38 inhibitors NOVARTIS A.G. (CH) 2010-01-26 US disclosed
US-20100004298-A1 P-38 INHIBITORS DONG QING 2010-01-07 US disclosed
EP-1635824-B1 5-MEMBERED HETEROCYCLE-BASED P-38 INHIBITORS NOVARTIS AG (CH) 2009-08-19 EP disclosed
US-20040254236-A1 P-38 inhibitors NOVARTIS AG (CH) 2004-12-16 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 (2 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-20100004298-A1 P-38 INHIBITORS MAPK8, MAPK1, MAP3K8 MAPK14 21/4885MAPK11 38/4885LMNA 1125/4885
US-20040254236-A1 P-38 inhibitors MAPK8, MAP3K8, MAPK1 MAPK14 12/4885MAPK11 41/4885LMNA 1333/4885

“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.