Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL4430504

O=C(O)C(F)(F)F.O=P(O)(O)F.O=P(O)(O)F.O=P(O)(O)F.O=P(O)(O)F.O=P(O)(O)F.O=P(O)(O)F

nearest known ligand 0.39

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PGK1 P00558 2/20 0.36
PGK2 P07205 2/20 0.36
ALDH1A1 P00352 2/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
PTPN1 P18031 1/20 0.35
THRB P10828 1/20 0.33
TSHR P16473 2/20 0.32
MEN1 O00255 1/20 0.32
LMNA P02545 1/20 0.32
HPGD P15428 1/20 0.32
BLM P54132 1/20 0.32
KMT2A Q03164 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
CA2 P00918 1/20 0.32
TP53 P04637 1/20 0.32
CES1 P23141 1/20 0.31
S1PR1 P21453 4/20 0.30
S1PR3 Q99500 4/20 0.30
S1PR2 O95136 3/20 0.30
S1PR5 Q9H228 3/20 0.30

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 SCHEMBL2728008 0.90 PGK1 (0.38) PGK1PGK2ALDH1A1L3MBTL1PTPN1
Trifluoroacetic Acid SCHEMBL28656139 0.84 PGK1 (0.35) PGK1PGK2ALDH1A1L3MBTL1PTPN1
Trifluoroacetic Acid SCHEMBL28679728 0.84 ALDH1A1 (0.35) PGK1PGK2ALDH1A1L3MBTL1PTPN1
Trifluoroacetic Acid SCHEMBL30657022 0.82
Trifluoroacetic Acid SCHEMBL2484766 0.82 ALDH1A1 (0.44) ALDH1A1L3MBTL1THRBTSHRMEN1
Trifluoroacetic Acid SCHEMBL7814389 0.82 ALDH1A1 (0.44) ALDH1A1L3MBTL1THRBTSHRMEN1
Trifluoroacetic Acid SCHEMBL474 0.82
Trifluoroacetic Acid SCHEMBL4598430 0.82
Trifluoroacetic Acid SCHEMBL28463674 0.81 SLC34A1 (0.44) PGK1PGK2ALDH1A1L3MBTL1PTPN1
SCHEMBL2215889 0.79 THRB (0.46) PGK1PGK2ALDH1A1L3MBTL1PTPN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9676735-B2 Process for the preparation of efavirenz and devices suitable therefore MAX-PLANCK-Gesellschaft zur Förderung der Wissenschaften e.V. (DE) 2017-06-13 US claimed
US-20170057937-A1 Process for the preparation of Efavirenz and devices suitable therefore MAX-PLANCK-GESELLSCHAFT ZUR FORDERUNG DER WISSENSCHAFTEN E.V. (DE) 2017-03-02 US claimed
EP-3757096-A1 REDOXINDICATORS Roche Diagnostics GmbH (DE) 2020-12-30 EP disclosed
EP-3183246-B1 REDOXINDICATORS ROCHE DIAGNOSTICS GMBH (DE) 2020-09-23 EP disclosed
EP-3414239-A2 INHIBITORS OF RECEPTOR-INTERACTING PROTEIN KINASE 1 Denali Therapeutics Inc. (US) 2018-12-19 EP disclosed
US-10060907-B2 Redoxindicators ROCHE DIAGNOSTIC OPERATIONS, INC. (US) 2018-08-28 US disclosed
WO-2017136727-A2 COMPOUNDS, COMPOSITIONS AND METHODS DENALI THERAPEUTICS INC. (US) 2017-08-10 WO disclosed
US-20170191990-A1 Redoxindicators ROCHE DIAGNOSTICS GMBH (DE) 2017-07-06 US disclosed
US-9676735-B2 Process for the preparation of efavirenz and devices suitable therefore MAX-PLANCK-Gesellschaft zur Förderung der Wissenschaften e.V. (DE) 2017-06-13 US disclosed
US-20170057937-A1 Process for the preparation of Efavirenz and devices suitable therefore MAX-PLANCK-GESELLSCHAFT ZUR FORDERUNG DER WISSENSCHAFTEN E.V. (DE) 2017-03-02 US disclosed
EP-2132186-A1 BICYCLIC ORGANIC COMPOUNDS SUITABLE FOR THE TREATMENT OF INFLAMMATORY OR ALLERGIC CONDITIONS Novartis AG (CH) 2009-12-16 EP disclosed
WO-2008107436-A1 BICYCLIC ORGANIC COMPOUNDS SUITABLE FOR THE TREATMENT OF INFLAMMATORY OR ALLERGIC CONDITIONS NOVARTIS AG (CH) 2008-09-12 WO 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 (3 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-20170191990-A1 Redoxindicators NQO1, SQOR, TST PGK1 3162/4885PGK2 2382/4885ALDH1A1 172/4885
US-20170057937-A1 Process for the preparation of Efavirenz and devices suitable therefore CYP3A4, CYP2C19, CYP3A43 PGK1 534/4885PGK2 1074/4885ALDH1A1 1319/4885
US-10060907-B2 Redoxindicators NQO1, SQOR, TST PGK1 3162/4885PGK2 2382/4885ALDH1A1 172/4885

“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.