Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL9057618

O=C(O)C(F)(F)F.O=C(O)C(F)(F)F.c1ccc(CNCc2cccc(-c3cc[nH]n3)c2)cc1

nearest known ligand 0.48

Full drug profile on Sugi Atlas →

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HDAC3 O15379 1/20 0.41
HDAC1 Q13547 1/20 0.41
HDAC2 Q92769 1/20 0.41
NCOR2 Q9Y618 1/20 0.41
PRKD1 Q15139 1/20 0.40
FFAR1 O14842 2/20 0.39
FFAR4 Q5NUL3 1/20 0.39
CASP3 P42574 1/20 0.39
SENP8 Q96LD8 1/20 0.39
SENP7 Q9BQF6 1/20 0.39
SENP6 Q9GZR1 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
ATM Q13315 3/20 0.39
PPARG P37231 1/20 0.38
PPARD Q03181 1/20 0.38
PPARA Q07869 1/20 0.38
AOC3 Q16853 1/20 0.38
METAP2 P50579 1/20 0.38

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
SCHEMBL8811307 0.89 BCHE (0.45) METAP2
SCHEMBL8808848 0.81 SMN1; SMN2 (0.46) L3MBTL1
SCHEMBL8812389 0.79 BCHE (0.50)
SCHEMBL8808069 0.77 KDM4E (0.53) HDAC1
SCHEMBL8810118 0.76 BCHE (0.45)
SCHEMBL29780316 0.76 FFAR1 (0.50) FFAR1FFAR4
SCHEMBL8812666 0.76 NOS1 (0.44) L3MBTL1
Trifluoroacetic Acid SCHEMBL1191360 0.76 HDAC3 (0.60) HDAC3HDAC1HDAC2NCOR2L3MBTL1
SCHEMBL8807896 0.75 MAPT (0.53) HDAC1
SCHEMBL8815345 0.74 KDM4E (0.56)

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
WO-1996010559-A1 UREA DERIVATIVES AND THEIR USE AS ACAT-INHIBITORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1996-04-11 WO disclosed