Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL23898105

O=C(O)C(F)(F)F.O=C(O)c1ccc(C#CCN2C[C@@H]3CNCCN3C2=O)cc1

nearest known ligand 0.35

Full drug profile on Sugi Atlas →

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ HTR2C P28335 11/20 0.35
▸ HTR2B P41595 9/20 0.35
▸ HTR2A P28223 9/20 0.34
▸ SCN9A Q15858 1/20 0.32
▸ MMP13 P45452 2/20 0.31
▸ LMNA P02545 1/20 0.30
▸ MAPK1 P28482 1/20 0.30
▸ RAB9A P51151 1/20 0.30
▸ RARB P10826 3/20 0.30
▸ RARG P13631 3/20 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
SCHEMBL20615913 0.94 HTR2C (0.37) HTR2CHTR2BHTR2AMMP13LMNA
SCHEMBL20615914 0.94 HTR2C (0.37) HTR2CHTR2BHTR2AMMP13LMNA
SCHEMBL21838861 0.86 HTR2C (0.34) HTR2CHTR2BHTR2ASCN9A
Trifluoroacetic Acid SCHEMBL31655669 0.83 F10 (0.39) HTR2CHTR2BHTR2A
SCHEMBL20615980 0.82 LMNA (0.35) HTR2CHTR2BHTR2ALMNAMAPK1
SCHEMBL20616273 0.81 HTR2C (0.33) HTR2CHTR2BHTR2ASCN9A
SCHEMBL20616178 0.81 HTR2C (0.38) HTR2CHTR2BHTR2ALMNA
Hydrochloric Acid SCHEMBL21838971 0.80 DPP4 (0.33) HTR2C
Hydrochloric Acid SCHEMBL23898124 0.80 DPP4 (0.33) HTR2C
Hydrochloric Acid SCHEMBL23898116 0.80 HTR2C (0.37) HTR2CHTR2BHTR2ALMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11142527-B2 Dihydropyrimidine compounds and uses thereof in medicine SUNSHINE LAKE PHARMA CO., LTD. (CN) 2021-10-12 — — 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-11142527-B2 Dihydropyrimidine compounds and uses thereof in medicine DPYD, SLC10A1, DHODH HTR2C 3558/4885HTR2B 3462/4885HTR2A 3720/4885

“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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