Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL7525892

NC(=O)Nc1ccccc1C(F)(F)F.O=C(O)C(F)(F)F

nearest known ligand 0.57

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHIT1 Q13231 1/20 0.57
POLB P06746 4/20 0.56
GAA P10253 1/20 0.55
GRIN2D O15399 1/20 0.54
GRIN3B O60391 1/20 0.54
GRIN1 Q05586 1/20 0.54
GRIN2A Q12879 1/20 0.54
GRIN2B Q13224 1/20 0.54
GRIN2C Q14957 1/20 0.54
GRIN3A Q8TCU5 1/20 0.54
SIGMAR1 Q99720 1/20 0.54
MEN1 O00255 2/20 0.53
KMT2A Q03164 2/20 0.53
KDM4E B2RXH2 2/20 0.53
SMN1; SMN2 Q16637 1/20 0.53
ALDH1A1 P00352 4/20 0.50
NPC1 O15118 1/20 0.50
RAB9A P51151 1/20 0.50
MAPK1 P28482 1/20 0.50
TDP1 Q9NUW8 1/20 0.50

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
SCHEMBL29958946 0.93 GRIN2D (0.60) POLBGAAGRIN2DGRIN3BGRIN1
SCHEMBL167598 0.93 GRIN2D (0.60) POLBGAAGRIN2DGRIN3BGRIN1
Carbamic Acid SCHEMBL1013202 0.84 POLB (0.58) POLBGAAGRIN2DGRIN3BGRIN1
SCHEMBL1008398 0.82 POLB (0.63) POLBGAAMEN1KMT2AKDM4E
SCHEMBL30140772 0.81 GRIN2D (0.55) POLBGAAGRIN2DGRIN3BGRIN1
SCHEMBL5801586 0.80 POLB (0.57) POLBGAAMEN1KMT2AKDM4E
SCHEMBL30499689 0.79 CA12 (0.57) POLBGAAGRIN2DGRIN3BGRIN1
SCHEMBL2755849 0.79 CA12 (0.57) POLBGAAGRIN2DGRIN3BGRIN1
SCHEMBL4094802 0.79 KDM4E (0.52) POLBGAAGRIN2DGRIN3BGRIN1
SCHEMBL27881391 0.79 FABP4 (0.63) POLBGAAGRIN2DGRIN3BGRIN1

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-2002024635-A2 AMINOALCOHOL DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2002-03-28 WO disclosed