Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL2711071

COC(=O)c1cc(C(=O)O)cc(N(C)S(C)(=O)=O)n1.O=C(O)C(F)(F)F

nearest known ligand 0.36

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.36
KDM4E B2RXH2 4/20 0.34
ALDH1A1 P00352 3/20 0.34
TSHR P16473 2/20 0.34
L3MBTL1 Q9Y468 2/20 0.34
MEN1 O00255 1/20 0.34
LMNA P02545 1/20 0.34
HSD17B10 Q99714 1/20 0.34
BACE1 P56817 6/20 0.34
ALOX15 P16050 1/20 0.33
HIF1A Q16665 1/20 0.33
SDHB P21912 2/20 0.33
MAPT P10636 1/20 0.33
KDM6B O15054 1/20 0.32
KDM5C P41229 1/20 0.32
KDM4C Q9H3R0 1/20 0.32
KDM2A Q9Y2K7 1/20 0.32
KDM3A Q9Y4C1 1/20 0.32
MAPK1 P28482 1/20 0.31
PTK2 Q05397 1/20 0.31

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
SCHEMBL6468199 0.93 KMT2A (0.40) KMT2AKDM4EALDH1A1TSHRL3MBTL1
SCHEMBL2711076 0.85 KMT2A (0.35) KMT2AKDM4EALDH1A1TSHRL3MBTL1
SCHEMBL2712407 0.81 KMT2A (0.37) KMT2AKDM4EALDH1A1TSHRL3MBTL1
SCHEMBL3510503 0.78 ALOX15 (0.44) KMT2AKDM4EALDH1A1TSHRL3MBTL1
Trifluoroacetic Acid SCHEMBL2709687 0.76 KDM4E (0.57) KDM4EALDH1A1TSHRL3MBTL1LMNA
SCHEMBL21144538 0.72 TSHR (0.61) KDM4EALDH1A1TSHRL3MBTL1LMNA
SCHEMBL21200897 0.71 ALOX15 (0.43) KMT2AKDM4EALDH1A1TSHRL3MBTL1
SCHEMBL2021183 0.71 TTR (0.38) KMT2AKDM4EALDH1A1TSHRMEN1
SCHEMBL2018841 0.70 KDM4E (0.42) KMT2AKDM4EALDH1A1TSHRL3MBTL1
SCHEMBL11956572 0.70 TSHR (0.69) KDM4EALDH1A1TSHRL3MBTL1LMNA

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-2012054510-A1 OXADIAZOLE COMPOUNDS WHICH INHIBIT BETA-SECRETASE ACTIVITY AND METHODS OF USE THEREOF COMENTIS, INC. (US) 2012-04-26 WO disclosed