Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL7394355

COC(=O)CCCNC(=O)Cn1ccn(-c2ccc(C(=N)N)cc2)c1=O.O=C(O)C(F)(F)F

nearest known ligand 0.41

Full drug profile on Sugi Atlas →

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
F2 P00734 5/20 0.41
TMPRSS6 Q8IU80 4/20 0.41
LMNA P02545 2/20 0.38
MAPT P10636 2/20 0.38
TP53 P04637 1/20 0.38
TMPRSS15 P98073 1/20 0.37
ITGB3 P05106 7/20 0.37
ITGA2B P08514 7/20 0.37
RXFP1 Q9HBX9 1/20 0.37
ITGB2 P05107 1/20 0.36
ITGAM P11215 1/20 0.36
KDM4E B2RXH2 1/20 0.36
F7 P08709 1/20 0.35
F3 P13726 1/20 0.35

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 SCHEMBL7396061 0.91 ITGB3 (0.44) F2TMPRSS6MAPTITGB3ITGA2B
SCHEMBL7396063 0.89 ITGB3 (0.37) F2TMPRSS6LMNAMAPTTP53
Trifluoroacetic Acid SCHEMBL7400268 0.87 ITGB3 (0.47) F2TMPRSS6MAPTITGB3ITGA2B
Trifluoroacetic Acid SCHEMBL7404770 0.87 ITGB3 (0.47) F2TMPRSS6LMNAMAPTTP53
SCHEMBL8543333 0.85 ITGB3 (0.49) MAPTITGB3ITGA2BRXFP1
SCHEMBL7400272 0.83 MAPT (0.37) F2TMPRSS6LMNAMAPTTP53
SCHEMBL7395044 0.81 ITGB3 (0.53) MAPTITGB3ITGA2BRXFP1ITGB2
Trifluoroacetic Acid SCHEMBL7397995 0.79 ITGB3 (0.46) F2TMPRSS6MAPTITGB3ITGA2B
Trifluoroacetic Acid SCHEMBL7405136 0.79 ITGB3 (0.49) F2TMPRSS6ITGB3ITGA2BITGB2
Trifluoroacetic Acid SCHEMBL7401536 0.77 ITGB3 (0.49) F2TMPRSS6ITGB3ITGA2BF7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0715623-B1 PLATELET AGGREGATION INHIBITORS SEARLE & CO (US) 1998-09-09 EP claimed
EP-0715623-A1 PLATELET AGGREGATION INHIBITORS G.D. SEARLE & CO. (US) 1996-06-12 EP claimed
US-5430043-A Platelet aggregation inhibitors G. D. SEARLE & CO. (US) 1995-07-04 US claimed
WO-1995006038-A1 PLATELET AGGREGATION INHIBITORS G.D. SEARLE & CO. (US) 1995-03-02 WO claimed
EP-0715623-B1 PLATELET AGGREGATION INHIBITORS SEARLE & CO (US) 1998-09-09 EP disclosed
EP-0715623-A1 PLATELET AGGREGATION INHIBITORS G.D. SEARLE & CO. (US) 1996-06-12 EP disclosed
US-5489594-A ANTICOAGULANTS G. D. SEARLE & CO. (US) 1996-02-06 US disclosed
US-5430043-A Platelet aggregation inhibitors G. D. SEARLE & CO. (US) 1995-07-04 US disclosed
WO-1995006038-A1 PLATELET AGGREGATION INHIBITORS G.D. SEARLE & CO. (US) 1995-03-02 WO disclosed