Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL6959531

COc1cc(C)c(C)cc1[N+](=O)[O-].O=C(O)C(F)(F)F

nearest known ligand 0.46

Full drug profile on Sugi Atlas →

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
ALDH1A1 P00352 6/20 0.44
GAA P10253 1/20 0.42
TDP1 Q9NUW8 2/20 0.42
CYP3A4 P08684 1/20 0.42
TSHR P16473 1/20 0.42
KMT2A Q03164 5/20 0.42
TTR P02766 1/20 0.41
MEN1 O00255 1/20 0.41
MAPT P10636 1/20 0.41
KDM4E B2RXH2 1/20 0.40

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
SCHEMBL8089043 0.85 ALDH1A1 (0.52) LMNASMN1; SMN2ALDH1A1GAATDP1
SCHEMBL19311886 0.78 ALDH1A1 (0.44) LMNASMN1; SMN2ALDH1A1TDP1CYP3A4
SCHEMBL19927626 0.78 LMNA (0.43) LMNASMN1; SMN2ALDH1A1GAATDP1
SCHEMBL10341213 0.78 PKM (0.55) LMNASMN1; SMN2ALDH1A1TDP1CYP3A4
SCHEMBL30180164 0.78 PKM (0.55) LMNASMN1; SMN2ALDH1A1TDP1CYP3A4
SCHEMBL14993397 0.78 PKM (0.51) LMNASMN1; SMN2ALDH1A1TDP1CYP3A4
SCHEMBL18159268 0.77 LMNA (0.42) LMNASMN1; SMN2ALDH1A1GAACYP3A4
SCHEMBL2955974 0.77 ALDH1A1 (0.53) LMNASMN1; SMN2ALDH1A1TDP1CYP3A4
SCHEMBL29738113 0.77 ALDH1A1 (0.50) LMNASMN1; SMN2ALDH1A1TDP1CYP3A4
SCHEMBL6370714 0.77 ALDH1A1 (0.50) LMNASMN1; SMN2ALDH1A1GAATDP1

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
EP-0850222-B1 PIPERAZINE DERIVATIVES AND PROCESS FOR THE PREPARATION THEREOF SAMJIN PHARM CO LTD (KR) 2003-05-28 EP disclosed