Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL4155417

CCC(=O)O.Nc1cccc(-c2ccc3[nH]c(=O)c4[nH]ccc4c3c2)c1.O=C(O)C(F)(F)F

nearest known ligand 0.36

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRIN2D O15399 1/20 0.36
GRIN3B O60391 1/20 0.36
GRIN1 Q05586 1/20 0.36
GRIN2A Q12879 1/20 0.36
GRIN2B Q13224 1/20 0.36
GRIN2C Q14957 1/20 0.36
GRIN3A Q8TCU5 1/20 0.36
GABRA1 P14867 2/20 0.36
GABRG2 P18507 2/20 0.36
GABRB3 P28472 2/20 0.36
GABRA5 P31644 2/20 0.36
GABRA3 P34903 2/20 0.36
GABRA2 P47869 2/20 0.36
GABRA6 Q16445 2/20 0.36
GABRA4 P48169 1/20 0.36
PARP1 P09874 1/20 0.34
PTGES O14684 2/20 0.34
PIM1 P11309 1/20 0.34
MME P08473 1/20 0.34
CYP3A4 P08684 1/20 0.34

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
Propionic Acid SCHEMBL4157572 0.94 GRIN2D (0.40) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
Propionic Acid SCHEMBL4162600 0.86 PARP1 (0.38) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
Propionic Acid SCHEMBL4153840 0.85 PIM1 (0.44) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL4713436 0.84 PARP1 (0.46) PARP1PTGESPIM1CDK2MAOA
Propionic Acid SCHEMBL4166173 0.83 GRIN2D (0.41) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
Propionic Acid SCHEMBL4165125 0.82 PARP1 (0.47) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
Propionic Acid SCHEMBL4161694 0.81 PARP1 (0.46) PARP1PIM1CYP3A4CYP2C19MAPT
Propionic Acid SCHEMBL4163092 0.81 GRIN2D (0.47) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
Propionic Acid SCHEMBL4153800 0.80 TRIM24 (0.43) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
Propionic Acid SCHEMBL4155344 0.79 FASN (0.42) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8426437-B2 Pyrroloquinoline derivatives and their use as protein kinases inhibitors PIERRE FABRE MEDICAMENT (FR) 2013-04-23 US disclosed
US-20090042876-A1 Pyrroloquinoline Derivatives And Their Use As Protein Kinases Inhibitors PIERRE FABRE MEDICAMENT (FR) 2009-02-12 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-20090042876-A1 Pyrroloquinoline Derivatives And Their Use As Protein Kinases Inhibitors MAP3K1, MAP3K2, MAP3K7 GRIN2D 1206/4885GRIN3B 714/4885GRIN1 529/4885

“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.