Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL2501753

CN(C)C(=O)[C@@H](N)Cc1cscn1.O=C(O)C(F)(F)F

nearest known ligand 0.41

Full drug profile on Sugi Atlas →

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 5/20 0.41
DPP8 Q6V1X1 4/20 0.41
DPP9 Q86TI2 4/20 0.41
OPRD1 P41143 1/20 0.41
OPRL1 P41146 1/20 0.38
GPR142 Q7Z601 9/20 0.37
NR1H2 P55055 1/20 0.34
NR1H3 Q13133 1/20 0.34
GPR88 Q9GZN0 1/20 0.34
KDM4C Q9H3R0 1/20 0.33
GRB2 P62993 1/20 0.33
DPP7 Q9UHL4 2/20 0.32

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
SCHEMBL1617776 0.91 DPP4 (0.45) DPP4DPP8DPP9OPRD1OPRL1
SCHEMBL1617758 0.91 DPP4 (0.45) DPP4DPP8DPP9OPRD1OPRL1
Hydrochloric Acid SCHEMBL6165352 0.89 DPP4 (0.44) DPP4DPP8DPP9OPRD1OPRL1
Hydrochloric Acid SCHEMBL6165347 0.89 DPP4 (0.44) DPP4DPP8DPP9OPRD1OPRL1
Trifluoroacetic Acid SCHEMBL5735676 0.85 GRB2 (0.46) DPP4DPP8DPP9OPRD1GPR142
Trifluoroacetic Acid SCHEMBL2495756 0.77 GRB2 (0.33) DPP4DPP8DPP9GRB2DPP7
SCHEMBL990478 0.76 DPP4 (0.49) DPP4DPP8DPP9OPRD1GPR142
SCHEMBL990477 0.76 DPP4 (0.49) DPP4DPP8DPP9OPRD1GPR142
SCHEMBL5907044 0.76 DPP4 (0.49) DPP4DPP8DPP9OPRD1GPR142
SCHEMBL5810527 0.75 OPRL1 (0.41) DPP4DPP8DPP9OPRD1OPRL1

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 DPP4 2704/4885DPP8 2961/4885DPP9 3556/4885

“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.