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Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL17895773

Cc1nc2c(n1CCN(C)C)CCCc1c-2[nH]c(=O)c(C(=O)O)c1O.O=C(O)C(F)(F)F

nearest known ligand 0.37

Full drug profile on Sugi Atlas →

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ CRHBP P24387 1/20 0.35
▸ CRHR2 Q13324 1/20 0.35
▸ HIF1A Q16665 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.35
▸ TP53 P04637 1/20 0.33
▸ MAPT P10636 1/20 0.33

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
SCHEMBL17896285 0.95 CRHBP (0.38) CRHBPCRHR2HIF1AALDH1A1TP53
SCHEMBL17896001 0.90 ALDH1A1 (0.37) CRHBPCRHR2HIF1AALDH1A1TP53
Trifluoroacetic Acid SCHEMBL17895971 0.89 LMNA (0.30) MAPT
Hydrochloric Acid SCHEMBL17895974 0.89 ALDH1A1 (0.37) CRHBPCRHR2HIF1AALDH1A1TP53
SCHEMBL17895774 0.85 CRHBP (0.33) CRHBPCRHR2HIF1ATP53MAPT
SCHEMBL17895779 0.84 LMNA (0.34) ALDH1A1MAPT
SCHEMBL17895899 0.83 LMNA (0.33) ALDH1A1MAPT
SCHEMBL17896078 0.82 HTT (0.34) ALDH1A1MAPT
SCHEMBL17896153 0.82 LMNA (0.37) ALDH1A1MAPT
SCHEMBL17895905 0.82 LMNA (0.34) ALDH1A1MAPT

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
WO-2016109706-A1 FUSED POLYCYCLIC 2-PYRIDINONE ANTIBACTERIAL COMPOUNDS PTC THERAPEUTICS, INC. (US) 2016-07-07 — — WO claimed
WO-2016109706-A1 FUSED POLYCYCLIC 2-PYRIDINONE ANTIBACTERIAL COMPOUNDS PTC THERAPEUTICS, INC. (US) 2016-07-07 — — WO disclosed
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