Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL9827341

N[C@@H](Cc1ccccc1)C(=O)NCC1CC(Br)=NO1.O=C(O)C(F)(F)F

nearest known ligand 0.59

Full drug profile on Sugi Atlas →

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TGM2 P21980 11/20 0.59
OPRK1 P41145 5/20 0.42
ITGB3 P05106 2/20 0.40
ITGA2B P08514 2/20 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
Trifluoroacetic Acid SCHEMBL10796044 0.80 TGM2 (0.52) TGM2ITGB3ITGA2B
SCHEMBL1091976 0.80 TGM2 (0.71) TGM2
SCHEMBL1091980 0.80 TGM2 (0.71) TGM2
SCHEMBL1091978 0.80 TGM2 (0.71) TGM2
SCHEMBL4935926 0.79 TGM2 (0.72) TGM2
SCHEMBL9827028 0.78 TGM2 (0.69) TGM2
SCHEMBL4657328 0.78 TGM2 (0.58) TGM2ITGB3ITGA2B
SCHEMBL1091157 0.78 TGM2 (0.93) TGM2
SCHEMBL1091124 0.78 TGM2 (0.93) TGM2
SCHEMBL1091158 0.78 TGM2 (0.93) TGM2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0237082-B1 3,5-DISUBSTITUTED 4,5-DIHYDROISOXAZOLES AS TRANSGLUTAMINASE INHIBITORS SYNTEX (U.S.A.) INC. (US) 1991-05-29 EP disclosed
US-4929630-A SKIN DISORDERS, ACNE, 4,5-DIHYDROISOOXAZOLE PEPTIDES SYNTEX (U.S.A.) INC. (US) 1990-05-29 US disclosed
US-4912120-A Containing amine and amide substitution SYNTEX (U.S.A.) INC. (US) 1990-03-27 US disclosed