Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL5224978

Clc1ccc(CC2CNC2)cc1.O=C(O)C(F)(F)F

nearest known ligand 0.52

Full drug profile on Sugi Atlas →

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 5/20 0.47
SLC6A4 P31645 5/20 0.47
SLC6A3 Q01959 5/20 0.47
CYP1A2 P05177 2/20 0.46
CYP3A4 P08684 2/20 0.46
CYP2D6 P10635 2/20 0.46
CYP2C9 P11712 2/20 0.46
CYP2C19 P33261 2/20 0.46
KCNH2 Q12809 1/20 0.44
REN P00797 5/20 0.41
CTSD P07339 2/20 0.41
CTSE P14091 2/20 0.41
PGC P20142 2/20 0.41
SMN1; SMN2 Q16637 1/20 0.40
SLC1A2 P43004 1/20 0.40

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 SCHEMBL23830443 0.86 SLC6A2 (0.61) SLC6A2SLC6A4SLC6A3CYP1A2CYP3A4
Trifluoroacetic Acid SCHEMBL17542042 0.86 SLC6A2 (0.53) SLC6A2SLC6A4SLC6A3CYP1A2CYP3A4
Trifluoroacetic Acid SCHEMBL3171388 0.85 GBA1 (0.53) KCNH2
Trifluoroacetic Acid SCHEMBL30548820 0.85 SLC6A4 (0.47) SLC6A2SLC6A4SLC6A3CYP1A2CYP3A4
SCHEMBL3914733 0.83 SLC6A4 (0.50) SLC6A2SLC6A4SLC6A3CYP3A4CYP2D6
Trifluoroacetic Acid SCHEMBL2301821 0.82 SLC6A4 (0.43) SLC6A2SLC6A4SLC6A3CYP1A2CYP3A4
Hydrochloric Acid SCHEMBL29090963 0.82 SLC6A4 (0.49) SLC6A2SLC6A4SLC6A3CYP3A4CYP2D6
Trifluoroacetic Acid SCHEMBL23455778 0.76 HTR3A (0.50) SLC6A2SLC6A3
Trifluoroacetic Acid SCHEMBL18497346 0.76 SLC6A2 (0.43) SLC6A2SLC6A4SLC6A3CYP1A2CYP3A4
Trifluoroacetic Acid SCHEMBL18863016 0.76 EPHX2 (0.54)

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-7288537-B2 Azetidine derivatives as CCR-3 receptor antagonists NOVARTIS AG (CH) 2007-10-30 US disclosed
EP-1663966-B1 1,3-DISUBSTITUTED AZETIDINE DERIVATIVES FOR USE AS CCR-3 RECEPTOR ANTAGONISTS IN THE TREATMENT OF INFLAMMATORY AND ALLERGIC DISEASES NOVARTIS AG (CH) 2007-06-20 EP disclosed
US-20070043013-A1 1,3 Disubstituted azetidine derivatives for use as ccr-3 receptor antagonists in the treatment of inflammatory and allergic diseases LE GRAND DARREN M 2007-02-22 US disclosed
CN-1849302-A 1, 3-disubstituted azetidine derivatives useful as CCR-3 receptor antagonists in the treatment of inflammatory and allergic diseases NOVARTIS AG (CH) 2006-10-18 CN disclosed
EP-1663966-A1 1,3-DISUBSTITUTED AZETIDINE DERIVATIVES FOR USE AS CCR-3 RECEPTOR ANTAGONISTS IN THE TREATMENT OF INFLAMMATORY AND ALLERGIC DISEASES Novartis AG (CH) 2006-06-07 EP disclosed
US-20050222118-A1 Azetidine derivatives as ccr-3 receptor antagonists NOVARTIS AG (CH) 2005-10-06 US disclosed
CN-1638761-A Azetidine derivatives as CCR-3 receptor antagonists NOVARTIS AG (CH) 2005-07-13 CN disclosed
WO-2005026113-A1 1, 3-DISUBSTITUTED AZETIDINE DERIVATIVES FOR USE AS CCR-3 RECEPTOR ANTAGONISTS IN THE TREATMENT OF INFLAMMATORY AND ALLERGIC DISEASES NOVARTIS AG (CH) 2005-03-24 WO disclosed
EP-1487435-A1 AZETIDINE DERIVATIVES AS CCR-3 RECEPTOR ANTAGONISTS Novartis AG (CH) 2004-12-22 EP disclosed
WO-2003077907-A1 AZETIDINE DERIVATIVES AS CCR-3 RECEPTOR ANTAGONISTS NOVARTIS AG (CH) 2003-09-25 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 (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-20050222118-A1 Azetidine derivatives as ccr-3 receptor antagonists CCR3, CCR1, CCR9 SLC6A2 1453/4885SLC6A4 1121/4885SLC6A3 372/4885
US-20070043013-A1 1,3 Disubstituted azetidine derivatives for use as ccr-3 receptor antagonists in the treatment of inflammatory and allergic diseases CCR1, CCR3, CCR9 SLC6A2 3873/4885SLC6A4 3261/4885SLC6A3 1927/4885

“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.