Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL5657716

NC(=O)Cc1ccc(F)cc1.O=C(O)C(F)(F)F

nearest known ligand 0.78

Full drug profile on Sugi Atlas →

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CA2 P00918 1/20 0.52
CTBP2 P56545 1/20 0.47
GAA P10253 2/20 0.44
CES1 P23141 1/20 0.44
ALDH1A1 P00352 1/20 0.44
RAB9A P51151 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.42
LMNA P02545 1/20 0.42
KMT2A Q03164 1/20 0.42
KDM4E B2RXH2 1/20 0.42
KCNN4 O15554 1/20 0.41

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
Bicarbonate SCHEMBL29794541 0.88 CA2 (0.59) CA2CTBP2GAAALDH1A1RAB9A
SCHEMBL328637 0.88 CA2 (0.64) CA2CTBP2GAASMN1; SMN2LMNA
Hydrochloric Acid SCHEMBL5795470 0.86 CA2 (0.61) CA2CTBP2GAASMN1; SMN2LMNA
Trifluoroacetic Acid SCHEMBL5657680 0.85 CA2 (0.74) CA2CTBP2CES1
Trifluoroacetic Acid SCHEMBL5892868 0.85 CES1 (0.62) CA2CES1SMN1; SMN2KMT2A
Trifluoroacetic Acid SCHEMBL5659772 0.84 CA2 (0.50) CA2CES1SMN1; SMN2KMT2A
Trifluoroacetic Acid SCHEMBL5659578 0.84 CA2 (0.50) CA2CTBP2CES1RAB9A
Trifluoroacetic Acid SCHEMBL26098787 0.84 CA2 (0.50) CA2
SCHEMBL13106182 0.82 CA2 (0.57) CA2CTBP2GAASMN1; SMN2LMNA
Trifluoroacetic Acid SCHEMBL28713743 0.81 LOXL2 (0.64) CTBP2SMN1; SMN2KDM4E

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7309701-B2 Pyridazinone derivatives as pharmaceuticals and pharmaceutical compositions containing them SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2007-12-18 US disclosed
US-6245746-B1 ADMINISTERING AMIDE MICROBIOCIDE ANTIBIOTIC MICROCIDE PHARMACEUTICALS, INC. 2001-06-12 US disclosed
US-6114310-A THERAPY FOR MICROBIAL INFECTIONS MICROCIDE PHARMACEUTICALS, INC. (US) 2000-09-05 US disclosed
WO-1999037667-A1 EFFLUX PUMP INHIBITORS MICROCIDE PHARMACEUTICALS, INC. (US) 1999-07-29 WO disclosed
US-5663297-A OLIGOPEPTIDES HOFFMANN-LA ROCHE INC. (US) 1997-09-02 US disclosed