Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL8412448

CN(C)c1cccc(Oc2nc(Oc3cc(C(=N)N)ccc3O)c(F)c(OC3CCN(CC(=O)O)C3)c2F)c1.O=C(O)C(F)(F)F

nearest known ligand 0.72

Full drug profile on Sugi Atlas →

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
F10 P00742 18/20 0.72
F2 P00734 15/20 0.72
F3 P13726 2/20 0.47
F7 P08709 1/20 0.47

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
SCHEMBL6578994 0.97 F10 (0.77) F10F2F3F7
SCHEMBL6579801 0.93 F10 (0.83) F10F2F3F7
SCHEMBL6581566 0.92 F10 (0.69) F10F2F3F7
SCHEMBL8412452 0.90 F10 (0.62) F10F2F3F7
SCHEMBL6581482 0.90 F10 (0.71) F10F2F3F7
SCHEMBL6579708 0.88 F10 (0.92) F10F2
SCHEMBL6577024 0.86 F10 (0.72) F10F2
SCHEMBL6581470 0.85 F10 (0.71) F10F2F3F7
SCHEMBL8068937 0.85 F10 (0.66) F10F2F3F7
SCHEMBL6576877 0.85 F10 (0.65) F10F2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6004981-A HUMAN FACTOR XA INHIBITORS BERLEX LABORATORIES, INC. 1999-12-21 US disclosed