Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL7323148

CCOC(=O)c1ccc(-c2cn3nc(-c4ccc(N5CCOCC5)cc4)sc3n2)cc1.O=C(O)C(F)(F)F

nearest known ligand 0.48

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.48
SIRT2 Q8IXJ6 1/20 0.47
SIRT1 Q96EB6 1/20 0.47
KDM4E B2RXH2 4/20 0.44
ALDH1A1 P00352 3/20 0.44
MAPT P10636 2/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
POLB P06746 1/20 0.44
DNMT1 P26358 1/20 0.44
APEX1 P27695 1/20 0.44
RECQL P46063 1/20 0.44
CACNA1B Q00975 1/20 0.44
APBA1 Q02410 1/20 0.44
CTDSP1 Q9GZU7 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
MTOR P42345 4/20 0.43
BTK Q06187 1/20 0.43

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
Trifluoroacetic Acid SCHEMBL7325659 0.92 SIRT2 (0.46) LMNASIRT2SIRT1KDM4EALDH1A1
Trifluoroacetic Acid SCHEMBL7324043 0.92 MTOR (0.42) LMNASIRT2SIRT1MAPTL3MBTL1
Trifluoroacetic Acid SCHEMBL7317609 0.91 TP53 (0.41) LMNASIRT2SIRT1ALDH1A1MAPT
Trifluoroacetic Acid SCHEMBL7320929 0.87 ALDH1A1 (0.42) LMNASIRT2SIRT1ALDH1A1MAPT
Trifluoroacetic Acid SCHEMBL6132999 0.87 SIRT2 (0.40) LMNASIRT2SIRT1MAPTPOLB
Trifluoroacetic Acid SCHEMBL6132355 0.86 MAPT (0.38) LMNAALDH1A1MAPTPOLBMEN1
Trifluoroacetic Acid SCHEMBL6539243 0.86 TP53 (0.56) KDM4EMAPTSMN1; SMN2RECQLTP53
Trifluoroacetic Acid SCHEMBL6132991 0.86 ALDH1A1 (0.39) LMNAALDH1A1MAPTL3MBTL1MEN1
Trifluoroacetic Acid SCHEMBL6134998 0.85 SIRT2 (0.40) LMNASIRT2SIRT1ALDH1A1MAPT
Trifluoroacetic Acid SCHEMBL7323795 0.84 CA12 (0.56) KDM4EALDH1A1MAPTSMN1; SMN2POLB

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-6232290-B1 FUNGICIDES AGAINST PNEUMOCYSTIS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2001-05-15 US disclosed