Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL8208936

N=C(N)Nc1ccc(C(=O)NCC[C@H]2C(=O)N(CC(=O)O)CCN2C(=O)CNC(=O)c2ccc(NC(=N)N)cc2)cc1.O=C(O)C(F)(F)F

nearest known ligand 0.65

Full drug profile on Sugi Atlas →

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ITGB3 P05106 20/20 0.65
ITGA2B P08514 20/20 0.65

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
SCHEMBL7285653 0.95 ITGB3 (0.71) ITGB3ITGA2B
Trifluoroacetic Acid SCHEMBL8215485 0.93 ITGB3 (0.67) ITGB3ITGA2B
SCHEMBL7293205 0.93 ITGB3 (0.76) ITGB3ITGA2B
SCHEMBL6157600 0.93 ITGB3 (0.76) ITGB3ITGA2B
Hydrochloric Acid SCHEMBL7335225 0.92 ITGB3 (0.75) ITGB3ITGA2B
Trifluoroacetic Acid SCHEMBL8206982 0.92 ITGB3 (0.77) ITGB3ITGA2B
SCHEMBL6157894 0.90 ITGB3 (0.69) ITGB3ITGA2B
SCHEMBL7295717 0.90 ITGB3 (0.69) ITGB3ITGA2B
Hydrochloric Acid SCHEMBL7024479 0.89 ITGB3 (0.68) ITGB3ITGA2B
SCHEMBL7294262 0.89 ITGB3 (0.68) ITGB3ITGA2B

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
US-6020334-A Piperazinones, their production and use TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2000-02-01 US disclosed
EP-0822931-A1 PIPERAZINONES USEFUL AS INHIBITORS OF PLATELET AGGREGATION Takeda Chemical Industries, Ltd. (JP) 1998-02-11 EP disclosed