Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL2396342

C[C@H](N)C(=O)NCc1ccccc1.O=C(O)C(F)(F)F

nearest known ligand 0.56

Full drug profile on Sugi Atlas →

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.56
CYP3A4 P08684 1/20 0.56
KMT2A Q03164 1/20 0.54
CARM1 Q86X55 5/20 0.54
MME P08473 1/20 0.54
CTRB1 P17538 3/20 0.52
PRMT6 Q96LA8 4/20 0.52
OPRK1 P41145 1/20 0.51
MMP8 P22894 1/20 0.50
SLC1A2 P43004 1/20 0.49

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
SCHEMBL6461987 0.91 KMT2A (0.63) ALDH1A1CYP3A4KMT2ACARM1MME
SCHEMBL2236118 0.91 KMT2A (0.63) ALDH1A1CYP3A4KMT2ACARM1MME
SCHEMBL1790978 0.91 KMT2A (0.63) ALDH1A1CYP3A4KMT2ACARM1MME
Hydrochloric Acid SCHEMBL5966886 0.89 CARM1 (0.62) ALDH1A1CYP3A4KMT2ACARM1MME
Trifluoroacetic Acid SCHEMBL10425462 0.88 ALDH1A1 (0.53) ALDH1A1CYP3A4KMT2AMMEOPRK1
Trifluoroacetic Acid SCHEMBL7101192 0.88 MMP8 (0.53) ALDH1A1CYP3A4KMT2AMMEOPRK1
Trifluoroacetic Acid SCHEMBL14762492 0.87 ALDH1A1 (0.56) ALDH1A1CYP3A4KMT2ACARM1MME
SCHEMBL8935468 0.84 CARM1 (0.58) ALDH1A1KMT2ACARM1MMEPRMT6
Trifluoroacetic Acid SCHEMBL10572656 0.83 ANPEP (0.55) ALDH1A1CYP3A4KMT2AMMEOPRK1
Trifluoroacetic Acid SCHEMBL18787156 0.83 CARM1 (0.52) ALDH1A1KMT2ACARM1PRMT6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2225238-B1 DERIVATIVES OF 6,7-DIHYDRO-5H-IMIDAZOÝ1,2- ¨IMIDAZOLE-3- CARBOXYLIC ACID AMIDES BOEHRINGER INGELHEIM INT (DE) 2014-09-03 EP disclosed
US-8552205-B2 Derivatives of 6,7-dihydro-5H-imidazo[1,2-alpha]imidazole-3-carboxylic acid amides BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2013-10-08 US disclosed
US-20110224188-A1 DERIVATIVES OF 6,7-DIHYDRO-5H-IMIDAZO[1,2-alpha]IMIDAZOLE-3-CARBOXYLIC ACID AMIDES BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2011-09-15 US disclosed
EP-2225238-A1 DERIVATIVES OF 6,7-DIHYDRO-5H-IMIDAZOÝ1,2- ¨IMIDAZOLE-3- CARBOXYLIC ACID AMIDES Boehringer Ingelheim International GmbH (DE) 2010-09-08 EP disclosed
WO-2009070485-A1 DERIVATIVES OF 6,7-DIHYDRO-5H-IMIDAZO[1,2-α]IMIDAZOLE-3- CARBOXYLIC ACID AMIDES BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2009-06-04 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 (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-20110224188-A1 DERIVATIVES OF 6,7-DIHYDRO-5H-IMIDAZO[1,2-alpha]IMIDAZOLE-3-CARBOXYLIC ACID AMIDES HPGDS, COL14A1, ARG1 ALDH1A1 1552/4885CYP3A4 2026/4885KMT2A 2995/4885

“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.