Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL5260636

O=C(O)C(F)(F)F.O=C(O)C(F)(F)F.O=C(c1n[nH]c(-c2ccc(F)cc2)c1-c1ccncc1)N1CCNCC1

nearest known ligand 0.49

Full drug profile on Sugi Atlas →

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ MAPK14 Q16539 9/20 0.49
▸ HTR3A P46098 1/20 0.43
▸ MAPK11 Q15759 2/20 0.41
▸ KCNH2 Q12809 1/20 0.41
▸ RAD52 P43351 1/20 0.41
▸ UBE2N P61088 1/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ NTRK1 P04629 1/20 0.39
▸ PKM P14618 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.37
▸ MKNK1 Q9BUB5 1/20 0.37
▸ MKNK2 Q9HBH9 1/20 0.37
▸ RIPK3 Q9Y572 2/20 0.37
▸ BRAF P15056 1/20 0.37
▸ HTR1A P08908 1/20 0.37
▸ HTR7 P34969 1/20 0.37
▸ HTR2B P41595 1/20 0.37
▸ HTR6 P50406 1/20 0.37

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
SCHEMBL5255779 0.95 MAPK14 (0.53) MAPK14HTR3AMAPK11KCNH2NTRK1
Water SCHEMBL27580370 0.94 MAPK14 (0.53) MAPK14HTR3AMAPK11KCNH2NTRK1
SCHEMBL27555288 0.86 MAPK14 (0.50) MAPK14MAPK11KCNH2SMN1; SMN2
SCHEMBL5255770 0.81 MAPK14 (0.45) MAPK14MAPK11KCNH2SMN1; SMN2
SCHEMBL5255490 0.77 MAPK14 (0.61) MAPK14MAPK11
Trifluoroacetic Acid SCHEMBL6199874 0.77 L3MBTL1 (0.62) MAPK14KCNH2RAD52UBE2NL3MBTL1
Water SCHEMBL5256024 0.76 MAPK14 (0.59) MAPK14MAPK11
Trifluoroacetic Acid SCHEMBL3961759 0.75 SIGMAR1 (0.61) KCNH2RAD52UBE2NL3MBTL1PKM
SCHEMBL14410980 0.73 MAPK14 (0.58) MAPK14HTR3AMAPK11HTR1AHTR7
Hydrochloric Acid SCHEMBL5254750 0.72 MAPK14 (0.57) MAPK14HTR3AMAPK11HTR1AHTR7

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
EP-1500657-B1 Substituted pyrazoles as P38 kinase inhibitors SEARLE LLC (US) 2007-09-19 — — EP disclosed
US-7153959-B2 treatment of tumor necrosis factor mediated disorders; asthma; inflammatory bowel disease; arthritis PHARMACIA CORPORATION (US) 2006-12-26 — — US disclosed
US-7071198-B1 Antiinflamamtory agents; antiarthritic agents; inflammatory bowel disorders; multiple sclerosis; asthma PHARMACIA CORPORATION (US) 2006-07-04 — — US disclosed
US-6979686-B1 Substituted pyrazoles as p38 kinase inhibitors PHARMACIA CORPORATION (US) 2005-12-27 — — US disclosed
EP-1500657-A1 Substituted pyrazoles as P38 kinase inhibitors G.D. Searle LLC (US) 2005-01-26 — — EP disclosed
EP-1144403-B1 SUBSTITUTED PYRAZOLES AS P38 KINASE INHIBITORS SEARLE LLC (US) 2004-10-06 — — EP disclosed
US-20040176433-A1 treatment of tumor necrosis factor mediated disorders; asthma; inflammatory bowel disease; arthritis PHARMACIA CORPORATION 2004-09-09 — — US disclosed
US-6617324-B1 Phenyl, cyclohexyl and pyridinyl or pyrimidinyl-substituted G. D. SEARLE & COMPANY 2003-09-09 — — US disclosed
US-6525059-B1 Mitogen-activated protein kinases (MAP); G. D. SEARLE & COMPANY 2003-02-25 — — US disclosed
US-6423713-B1 Substituted pyrazoles as p38 kinase inhibitors G. D. SEARLE & COMPANY 2002-07-23 — — 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-20040176433-A1 treatment of tumor necrosis factor mediated disorders; asthma; inflammatory bowel disease; arthritis MAPK1, IL1R1, TNF MAPK14 12/4885HTR3A 1467/4885MAPK11 96/4885

“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.

Send feedback