Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL2495756

CN(C)C(=O)[C@@H](N)Cc1c[nH]cn1.O=C(O)C(F)(F)F

nearest known ligand 0.33

Full drug profile on Sugi Atlas →

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GRB2 P62993 1/20 0.33
DPP4 P27487 14/20 0.32
DPP7 Q9UHL4 11/20 0.32
DPP9 Q86TI2 5/20 0.32
DPP8 Q6V1X1 4/20 0.32
HRH4 Q9H3N8 2/20 0.31
HRH3 Q9Y5N1 2/20 0.31
PTPN1 P18031 1/20 0.31
CIT O14578 1/20 0.30
KCNH2 Q12809 1/20 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
Histidine SCHEMBL29740915 0.85 GRB2 (0.46) GRB2PTPN1
Histidinol SCHEMBL12505551 0.80 HRH4 (0.34) GRB2HRH4HRH3PTPN1
Histidine SCHEMBL15302885 0.79 SLC7A5 (0.43)
Histidine SCHEMBL15302886 0.79 SLC7A5 (0.43)
SCHEMBL30121454 0.79 NLN (0.33) DPP4DPP9
SCHEMBL6118029 0.79 NLN (0.34) CIT
Histidine SCHEMBL28847645 0.78 SLC7A5 (0.44)
Histidine SCHEMBL29260571 0.78 SLC7A5 (0.44)
SCHEMBL3632927 0.77
Trifluoroacetic Acid SCHEMBL2501753 0.77 DPP4 (0.41) GRB2DPP4DPP7DPP9DPP8

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-8030499-B2 1,3-dihydro-2H-indole-2-one compound and pyrrolidine-2-one compound fused with aromatic heterocycle TAISHO PHARMACEUTICAL CO., LTD. (JP) 2011-10-04 US disclosed
US-20080318923-A1 1,3-Dihydro-2H-Indole-2-One Compound and Pyrrolidine-2-One Compound Fused With Aromatic Heterocycle TAISHO PHARMACEUTICAL CO., LTD. (JP) 2008-12-25 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-20080318923-A1 1,3-Dihydro-2H-Indole-2-One Compound and Pyrrolidine-2-One Compound Fused With Aromatic Heterocycle AVPR1B, AVPR1A, AVPR2 GRB2 3129/4885DPP4 2704/4885DPP7 3265/4885

“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.