Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL5494836

CCCCCC.CCNCC.CCO.O=C(O)C(F)(F)F

nearest known ligand 0.47

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

CCKAR

The experimentally established mechanism targets of Trifluoroacetic Acid. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
FAAH O00519 12/20 0.47
EPHX1 P07099 1/20 0.46
CES1 P23141 9/20 0.45
CES2 O00748 7/20 0.45
MEN1 O00255 1/20 0.45
CYP1A2 P05177 1/20 0.45
KMT2A Q03164 1/20 0.45
HSD17B10 Q99714 1/20 0.45
FUCA1 P04066 1/20 0.43
PLA2G6 O60733 1/20 0.39
S1PR2 O95136 1/20 0.38
S1PR1 P21453 1/20 0.38
S1PR3 Q99500 1/20 0.38
S1PR5 Q9H228 1/20 0.38

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 SCHEMBL28395953 0.96 FAAH (0.50) FAAHEPHX1CES1CES2MEN1
Trifluoroacetic Acid SCHEMBL28392985 0.93 FAAH (0.41) FAAHEPHX1CES1CES2MEN1
Trifluoroacetic Acid SCHEMBL28399119 0.91 TP53 (0.40) FAAHEPHX1CES1CES2MEN1
Trifluoroacetic Acid SCHEMBL28666896 0.89 TP53 (0.38) FAAHEPHX1CES1CES2MEN1
Trifluoroacetic Acid SCHEMBL5880385 0.89 FAAH (0.56) FAAHEPHX1CES1CES2MEN1
Trifluoroacetic Acid SCHEMBL5238463 0.88 FAAH (0.44) FAAHEPHX1CES1CES2MEN1
Trifluoroacetic Acid SCHEMBL12520341 0.87 FAAH (0.54) FAAHEPHX1CES1CES2MEN1
Heptane SCHEMBL1776021 0.87 FAAH (0.58) FAAHEPHX1CES1CES2MEN1
Trifluoroacetic Acid SCHEMBL2242176 0.87 TP53 (0.44) FAAHEPHX1CES1CES2MEN1
Trifluoroacetic Acid SCHEMBL28562828 0.86 FAAH (0.42) FAAHEPHX1CES1CES2MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111413435-B Detection method of tamsulosin hydrochloride intermediate 珠海润都制药股份有限公司 2022-07-08 CN claimed
CN-111413435-A Detection method of tamsulosin hydrochloride intermediate 珠海润都制药股份有限公司 2020-07-14 CN claimed
CN-106442765-A Method for detecting isomers of dexmedetomidine hydrochloride crude product 辰欣药业股份有限公司 2017-02-22 CN claimed
CN-115452993-A Separation and detection method of isomers of pasiclovir intermediate 南京药坦生物科技有限公司 2022-12-09 CN disclosed
CN-111413435-B Detection method of tamsulosin hydrochloride intermediate 珠海润都制药股份有限公司 2022-07-08 CN disclosed
CN-111175387-B Method for detecting milnacipran isomer 成都康弘药业集团股份有限公司 2022-06-07 CN disclosed
CN-111413435-A Detection method of tamsulosin hydrochloride intermediate 珠海润都制药股份有限公司 2020-07-14 CN disclosed
CN-111323493-A Method for detecting enantiomer of posaconazole starting material 武汉赛沃医药科技有限公司 2020-06-23 CN disclosed
CN-111175387-A Method for detecting milnacipran isomer 成都康弘药业集团股份有限公司 2020-05-19 CN disclosed
CN-109239231-A A kind of chiral isomer analysis method 药源生物科技(启东)有限公司 2019-01-18 CN disclosed
CN-106442765-A Method for detecting isomers of dexmedetomidine hydrochloride crude product 辰欣药业股份有限公司 2017-02-22 CN disclosed
EP-1295870-B1 SUPLATAST TOSILATE CRYSTALS TAIHO PHARMACEUTICAL CO LTD (JP) 2007-12-19 EP disclosed
US-7138140-B2 Suplatast tosilate crystals TAIHO PHARMACEUTICAL CO., LTD. (JP) 2006-11-21 US disclosed
CN-1205182-C suplatast tosilate crystals TAIHO PHARMACEUTICAL CO LTD (JP) 2005-06-08 CN disclosed
CN-1461297-A Suplatast tosilate crystals TAIHO PHARMACEUTICAL CO LTD (JP) 2003-12-10 CN disclosed
US-20030149105-A1 Suplatast tosilate crystals TAIHO PHARMACEUTICAL CO., LTD. (JP) 2003-08-07 US disclosed
EP-1295870-A1 SUPLATAST TOSILATE CRYSTALS TAIHO PHARMACEUTICAL COMPANY LIMITED (JP) 2003-03-26 EP 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-20030149105-A1 Suplatast tosilate crystals SART3, SOST, PRPF19 FAAH 2851/4885EPHX1 4775/4885CES1 2413/4885

“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.