Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL2261833

CC(C)n1nc(C(=O)N[C@@H]2C[C@H]3CC[C@@H](C2)N3)c2ccccc21.O=C(O)C(F)(F)F

nearest known ligand 0.88

Full drug profile on Sugi Atlas →

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ HTR4 Q13639 20/20 0.88

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
SCHEMBL2261477 0.94 HTR4 (1.00) HTR4
SCHEMBL12227452 0.94 HTR4 (1.00) HTR4
SCHEMBL8039331 0.94 HTR4 (1.00) HTR4
SCHEMBL8714839 0.85 HTR4 (0.82) HTR4
SCHEMBL8714841 0.85 HTR4 (0.82) HTR4
SCHEMBL2538722 0.82 HTR4 (0.74) HTR4
SCHEMBL16504004 0.80 HTR4 (0.81) HTR4
SCHEMBL7429870 0.79 HTR4 (1.00) HTR4
Hydrochloric Acid SCHEMBL3170515 0.78 HTR4 (0.98) HTR4
SCHEMBL7431308 0.77 HTR4 (0.76) HTR4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8003664-B2 Indazole-carboxamide compounds THERAVANCE, INC. (US) 2011-08-23 — — US disclosed
US-7786136-B2 Indazole-carboxamide compounds THERAVANCE, INC. (US) 2010-08-31 — — US disclosed
US-20080132491-A1 Indazole-carboxamide compounds THERAVANCE BIOPHARMA R&D IP, LLC 2008-06-05 — — 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-20080132491-A1 Indazole-carboxamide compounds HTR4, HTR5A, HTR3B HTR4 1/4885

“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.

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