Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL7479530

N=C(N)Oc1cc(CN2CC[C@H](NS(=O)(=O)c3cc4nc(Cl)ccc4s3)C2=O)cs1.O=C(O)C(F)(F)F

nearest known ligand 0.64

Full drug profile on Sugi Atlas →

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
F10 P00742 20/20 0.64
F2 P00734 8/20 0.64
PLG P00747 6/20 0.64
PROC P04070 7/20 0.60
PRSS1 P07477 6/20 0.60
PLAT P00750 5/20 0.60

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 SCHEMBL8040172 0.90 F10 (0.68) F10F2PLGPROCPRSS1
Trifluoroacetic Acid SCHEMBL8040173 0.90 F10 (0.68) F10F2PLGPROCPRSS1
Trifluoroacetic Acid SCHEMBL7480117 0.84 F10 (0.89) F10F2PLGPROCPRSS1
Trifluoroacetic Acid SCHEMBL7480111 0.84 F10 (0.89) F10F2PLGPROCPRSS1
Trifluoroacetic Acid SCHEMBL7477898 0.82 F10 (0.89) F10F2PLGPROCPRSS1
Trifluoroacetic Acid SCHEMBL7477888 0.82 F10 (0.89) F10F2PLGPROCPRSS1
Trifluoroacetic Acid SCHEMBL7476266 0.82 F10 (0.89) F10F2PLGPROCPRSS1
Trifluoroacetic Acid SCHEMBL7473699 0.81 F10 (0.68) F10F2PLGPROCPRSS1
Trifluoroacetic Acid SCHEMBL7486463 0.81 F10 (0.68) F10F2PLGPROCPRSS1
Trifluoroacetic Acid SCHEMBL8625070 0.80 F10 (0.54) F10F2PLGPROCPRSS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0894088-A4 SUBSTITUTED SULFONIC ACID N- (AMINOIMINOMETHYL)PHENYLALKYL]-AZAHETEROCYCLAMIDE COMPOUNDS RHONE POULENC RORER PHARMA (US) 2001-12-05 EP disclosed
US-6034093-A Substituted sulfonic acid N-[(aminoiminomethyl)phenylalkyl]-azaheterocyclylamide compounds RHONE-POULENC RORER PHARMACEUTICALS INC. (US) 2000-03-07 US disclosed
EP-0894088-A1 SUBSTITUTED SULFONIC ACID N- (AMINOIMINOMETHYL)PHENYLALKYL]-AZAHETEROCYCLAMIDE COMPOUNDS RHONE-POULENC RORER PHARMACEUTICALS, INC. (US) 1999-02-03 EP disclosed
WO-1998024784-A1 SUBSTITUTED SULFONIC ACID N-[(AMINOIMINOMETHYL)PHENYLALKYL]-AZAHETEROCYCLAMIDE COMPOUNDS RHONE-POULENC RORER PHARMACEUTICALS INC. (US) 1998-06-11 WO disclosed