Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL7448255

N=C(N)c1ccc(N2CCN(C3CCN(C(CCc4ccccc4)C(=O)O)CC3)CC2)cc1.O=C(O)C(F)(F)F

nearest known ligand 0.53

Full drug profile on Sugi Atlas →

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ITGB3 P05106 12/20 0.53
ITGA2B P08514 12/20 0.53
ALOX15 P16050 1/20 0.52
MAPT P10636 1/20 0.42
F2 P00734 2/20 0.41
F10 P00742 2/20 0.41
KDM4E B2RXH2 3/20 0.41
PRSS1 P07477 1/20 0.40
ALDH1A1 P00352 1/20 0.40
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39

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
SCHEMBL7435921 0.95 ITGB3 (0.59) ITGB3ITGA2BALOX15MAPTF2
Trifluoroacetic Acid SCHEMBL7443965 0.92 ITGB3 (0.56) ITGB3ITGA2BALOX15F2F10
SCHEMBL7435280 0.87 ITGB3 (0.61) ITGB3ITGA2BALOX15MAPTF2
Trifluoroacetic Acid SCHEMBL7440547 0.85 ITGB3 (0.50) ITGB3ITGA2BALOX15F2F10
Trifluoroacetic Acid SCHEMBL7442158 0.83 ITGB3 (0.56) ITGB3ITGA2BALOX15F2F10
Trifluoroacetic Acid SCHEMBL7444687 0.83 ITGB3 (0.50) ITGB3ITGA2BALOX15F2F10
SCHEMBL7446782 0.81 ITGB3 (0.65) ITGB3ITGA2BALOX15F2KDM4E
Trifluoroacetic Acid SCHEMBL7431494 0.80 ITGB3 (0.50) ITGB3ITGA2BALOX15F2KDM4E
Trifluoroacetic Acid SCHEMBL7437557 0.80 ITGB3 (0.52) ITGB3ITGA2BALOX15F2F10
Trifluoroacetic Acid SCHEMBL7448252 0.80 ITGB3 (0.52) ITGB3ITGA2BALOX15F2KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0623120-A1 PIPERIDINEACETIC ACID DERIVATIVES AS INHIBITORS OF FIBRINOGEN-DEPENDENT BLOOD PLATELET AGGREGATION GLAXO GROUP LIMITED (GB) 1994-11-09 EP disclosed
WO-1993014077-A1 PIPERIDINEACETIC ACID DERIVATIVES AS INHIBITORS OF FIBRINOGEN-DEPENDENT BLOOD PLATELET AGGREGATION GLAXO GROUP LIMITED (GB) 1993-07-22 WO disclosed