Trifluoroacetic Acid

SCHEMBL2329155

N=C(N)c1cccc(CN2CC[C@H](NS(=O)(=O)c3ccc4ncccc4c3)C2=O)c1.O=C(O)C(F)(F)F

nearest known ligand 0.88

Predicted protein targets (top 6)

	gene	UniProt	supporting neighbours	confidence
▸	F10	P00742	20/20	0.88

▸	PROC	P04070	2/20	0.70

▸	PLG	P00747	1/20	0.70

▸	F2	P00734	5/20	0.66

▸	PLAT	P00750	1/20	0.64

▸	PRSS1	P07477	1/20	0.64

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.

Compound	similarity	top predicted	shared targets
Trifluoroacetic Acid SCHEMBL1188533	0.90	F10 (0.87)	F10PROCPLGF2PRSS1
Trifluoroacetic Acid SCHEMBL7479261	0.87	F10 (0.89)	F10PROCPLGF2
Trifluoroacetic Acid SCHEMBL7479267	0.87	F10 (0.89)	F10PROCPLGF2
Trifluoroacetic Acid SCHEMBL7477119	0.87	F10 (0.89)	F10PROCPLGF2
Trifluoroacetic Acid SCHEMBL2332372	0.86	F10 (0.88)	F10PROCPLGF2PRSS1
Trifluoroacetic Acid SCHEMBL2329357	0.85	F10 (0.88)	F10PROCPLGF2PRSS1
Trifluoroacetic Acid SCHEMBL2325887	0.85	F10 (0.88)	F10PROCPLGF2PRSS1
Trifluoroacetic Acid SCHEMBL2334002	0.85	F10 (0.88)	F10PROCPLGF2
Trifluoroacetic Acid SCHEMBL7480779	0.85	F10 (0.89)	F10PROCPLGF2PLAT
Trifluoroacetic Acid SCHEMBL7482743	0.85	F10 (0.89)	F10PROCPLGF2PLAT

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.

Patent	Title	Assignee	Published	Priority	Filing	Country	Status
EP-0853618-B1	SUBSTITUTED (SULFINIC ACID, SULFONIC ACID, SULFONYLAMINO OR SULFINYLAMINO) N- (AMINOIMINOMETHYL)PHENYLALKYL -AZAHETEROCYCLYLAMIDE COMPOUNDS	AVENTIS PHARMA INC (US)	2011-08-17	—	—	EP	disclosed