Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL4023809

CC(C)CCCCCc1[nH]cc[n+]1C.O=C([O-])C(F)(F)F

nearest known ligand 0.32

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Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 1/20 0.32
EPAS1 Q99814 1/20 0.32
CCR5 P51681 2/20 0.31

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
SCHEMBL4578674 0.85 HIF1A (0.36) HIF1AEPAS1
SCHEMBL4446904 0.85 HIF1A (0.36) HIF1AEPAS1
SCHEMBL1427748 0.85 HIF1A (0.36) HIF1AEPAS1
SCHEMBL5302232 0.85 HIF1A (0.36) HIF1AEPAS1
SCHEMBL5074274 0.85 HIF1A (0.36) HIF1AEPAS1
SCHEMBL5291441 0.85 HIF1A (0.36) HIF1AEPAS1
SCHEMBL5283126 0.85 HIF1A (0.36) HIF1AEPAS1
SCHEMBL2774591 0.85 HIF1A (0.36) HIF1AEPAS1
Trifluoroacetic Acid SCHEMBL16699395 0.84 CCR5 (0.40) CCR5
Bromide SCHEMBL4021634 0.84 HIF1A (0.36) HIF1AEPAS1

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-2063985-A2 IONIC ADDITIVE FOR CATALYSIS IN BIPHASIC REACTION SYSTEMS The University Court of the University of St. Andrews (GB) 2009-06-03 EP disclosed
WO-2008023171-A2 IONIC ADDITIVE FOR CATALYSIS IN BIPHASIC REACTION SYSTEMS THE UNIVERSITY COURT OF THE UNIVERSITY OF ST ANDREWS (GB) 2008-02-28 WO disclosed