Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL7334476

Cc1cc(OCCCc2ccc3c(c2)C(=O)N(C(C)CC(=O)O)CC(=O)N3C(C)C)nc(N)n1.O=C(O)C(F)(F)F

nearest known ligand 0.37

Full drug profile on Sugi Atlas →

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ITGB3 P05106 6/20 0.37
ITGA2B P08514 6/20 0.37
RXRA P19793 3/20 0.36
CYP1A2 P05177 1/20 0.30
CYP2C19 P33261 1/20 0.30

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 SCHEMBL7333191 0.92 ITGB3 (0.45) ITGB3ITGA2BRXRACYP1A2CYP2C19
Trifluoroacetic Acid SCHEMBL7334590 0.91 MEN1 (0.36) ITGB3ITGA2BRXRA
SCHEMBL7334478 0.91 RXRA (0.32) ITGB3ITGA2BRXRACYP1A2CYP2C19
Trifluoroacetic Acid SCHEMBL7332347 0.90 ITGB3 (0.36) ITGB3ITGA2B
Trifluoroacetic Acid SCHEMBL7329664 0.89 ITGB3 (0.35) ITGB3ITGA2B
SCHEMBL7334599 0.85 RXRA (0.31) RXRA
SCHEMBL7333196 0.83 ITGB3 (0.38) ITGB3ITGA2BCYP1A2CYP2C19
Trifluoroacetic Acid SCHEMBL8842983 0.83 RXRA (0.30) RXRA
Trifluoroacetic Acid SCHEMBL7328309 0.82 MEN1 (0.37) ITGB3ITGA2BRXRA
Trifluoroacetic Acid SCHEMBL7326509 0.82 ITGB3 (0.37) ITGB3ITGA2BRXRA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5663166-A ANTICOAGULANTS OF 1,4-BENZODIAZEPINE-2,5-DIONE AND 2-BENZOAZEPINE-1,4-DIONE DERIVATIVES; PREVENTS FIBRINOGEN BINDING NECESSARY FOR PLATELET AGGREGATION; SIDE EFFECT REDUCTION, E.G. EXCESSIVE BLEEDING GENENTECH, INC. (US) 1997-09-02 US disclosed
US-5565449-A PLATELET AGGREGATION INHIBITORS GENENTECH, INC. (US) 1996-10-15 US disclosed
EP-0610334-B1 NONPEPTIDYL INTEGRIN INHIBITORS HAVING SPECIFICITY FOR THE GPII B III A RECEPTOR GENENTECH INC (US) 1996-01-24 EP disclosed
US-5403836-A Anticoagulants GENENTECH, INC. (US) 1995-04-04 US disclosed
EP-0610334-A1 NONPEPTIDYL INTEGRIN INHIBITORS HAVING SPECIFICITY FOR THE GPII b?III a? RECEPTOR. GENENTECH INC (US) 1994-08-17 EP disclosed
US-5250679-A Nonpeptidyl platelet aggregation inhibitors having specificity for the GPIIb III.sub. receptor GENENTECH, INC. (US) 1993-10-05 US disclosed
WO-1993008174-A1 NONPEPTIDYL INTEGRIN INHIBITORS HAVING SPECIFICITY FOR THE GPIIbIIIa RECEPTOR GENENTECH, INC. (US) 1993-04-29 WO disclosed