Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL6538796

CS(=O)(=O)Nc1ccc(NC(=O)Nc2ccc(C[C@@H](CO)NC[C@H](O)COc3ccccc3)cc2)cc1.O=C(O)C(F)(F)F

nearest known ligand 0.75

Full drug profile on Sugi Atlas →

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ADRB3 P13945 17/20 0.75
ADRB1 P08588 15/20 0.75
ADRB2 P07550 3/20 0.56

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 SCHEMBL6539442 0.94 ADRB3 (0.72) ADRB3ADRB1ADRB2
Trifluoroacetic Acid SCHEMBL6538789 0.93 ADRB3 (0.70) ADRB3ADRB1ADRB2
Trifluoroacetic Acid SCHEMBL6538892 0.89 ADRB3 (0.79) ADRB3ADRB1ADRB2
Trifluoroacetic Acid SCHEMBL6539537 0.88 ADRB3 (0.81) ADRB3ADRB1ADRB2
Trifluoroacetic Acid SCHEMBL6539502 0.88 ADRB3 (0.80) ADRB3ADRB1ADRB2
SCHEMBL7532289 0.87 ADRB3 (0.58) ADRB3ADRB1ADRB2
Trifluoroacetic Acid SCHEMBL6538830 0.87 ADRB3 (0.76) ADRB3ADRB1ADRB2
Trifluoroacetic Acid SCHEMBL6539484 0.87 ADRB3 (0.91) ADRB3ADRB1ADRB2
Trifluoroacetic Acid SCHEMBL6541338 0.86 ADRB3 (0.75) ADRB3ADRB1ADRB2
SCHEMBL6538626 0.86 ADRB3 (1.00) ADRB3ADRB1ADRB2

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
US-6826033-B2 BETA 3 ADRENERGIC RECEPTOR AGONISTS; TREATMENT OF POLLAKIURIA, URINARY INCONTINENCE, OBESITY OR DIABETES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-11-30 US disclosed
US-20040037022-A1 Aminoalcohol derivatives ASTELLAS PHARMA INC. (JP) 2004-02-26 US disclosed
WO-2002024635-A2 AMINOALCOHOL DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2002-03-28 WO disclosed