Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL31335937

C=C(C(N)=O)c1ccc2c(c1)CNCC2.O=C(O)C(F)(F)F

nearest known ligand 0.64

Full drug profile on Sugi Atlas →

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ MELK Q14680 1/20 0.44
▸ PNMT P11086 6/20 0.41
▸ ADRA2A P08913 2/20 0.41
▸ ADRA2B P18089 2/20 0.41
▸ ADRA2C P18825 2/20 0.41
▸ SLC2A1 P11166 1/20 0.39

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
SCHEMBL4544279 0.91 MELK (0.48) MELKPNMTADRA2AADRA2BADRA2C
SCHEMBL4543801 0.85 PLAU (0.49) MELKPNMTADRA2AADRA2BADRA2C
Trifluoroacetic Acid SCHEMBL29819945 0.79 PNMT (0.47) MELKPNMTADRA2AADRA2BADRA2C
Trifluoroacetic Acid SCHEMBL7746107 0.79 PNMT (0.47) MELKPNMTADRA2AADRA2BADRA2C
Trifluoroacetic Acid SCHEMBL1077606 0.79 MELK (0.51) MELKPNMTSLC2A1
SCHEMBL3247716 0.78 MELK (0.52) MELKPNMTADRA2AADRA2BADRA2C
SCHEMBL29728413 0.76 PNMT (0.53) MELKPNMTADRA2AADRA2BADRA2C
SCHEMBL1033504 0.76 PNMT (0.53) MELKPNMTADRA2AADRA2BADRA2C
Hydrochloric Acid SCHEMBL17748278 0.75 PNMT (0.51) MELKPNMTADRA2AADRA2BADRA2C
Trifluoroacetic Acid SCHEMBL30182594 0.75 MELK (0.77) MELKSLC2A1

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
EP-4720038-A1 (HETERO)ARYL-CARBONYL-HETEROBICYCLIC COMPOUNDS AS INHIBITORS OF PMS2 FOR CANCER AND DEGENERATIVE ILLNESSES Neophore Limited (GB) 2026-04-08 — — EP disclosed
WO-2024246496-A1 (HETERO)ARYL-CARBONYL-HETEROBICYCLIC COMPOUNDS AS INHIBITORS OF PMS2 FOR CANCER AND DEGENERATIVE ILLNESSES Neophore Limited (GB) 2024-12-05 — — WO disclosed
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