Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL7423282

NC[C@@H]1CCN(Cc2cccc(C=NN)c2)C1=O.O=C(O)C(F)(F)F

nearest known ligand 0.35

Full drug profile on Sugi Atlas →

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HRH2 P25021 3/20 0.35
F10 P00742 7/20 0.35
TPSAB1 Q15661 2/20 0.33
KMT2A Q03164 1/20 0.33
GPR6 P46095 1/20 0.33
F2 P00734 1/20 0.33
PRSS1 P07477 1/20 0.33
KCNH2 Q12809 1/20 0.33
RAD52 P43351 1/20 0.33
CTSL P07711 1/20 0.33
PLG P00747 1/20 0.33
PROC P04070 1/20 0.33

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
SCHEMBL7413862 0.91 KCNH2 (0.37) F10F2KCNH2PLGPROC
Trifluoroacetic Acid SCHEMBL8834439 0.88 F10 (0.35) HRH2F10KMT2AGPR6F2
Trifluoroacetic Acid SCHEMBL7421271 0.88 F10 (0.35) HRH2F10KMT2AGPR6F2
Trifluoroacetic Acid SCHEMBL2329902 0.88 F10 (0.35) HRH2F10KMT2AGPR6F2
Trifluoroacetic Acid SCHEMBL7425174 0.86 HRH2 (0.36) HRH2F10GPR6F2CTSL
Trifluoroacetic Acid SCHEMBL7418499 0.86 KCNH2 (0.35) HRH2F10GPR6KCNH2CTSL
Trifluoroacetic Acid SCHEMBL7423939 0.84 OPRD1 (0.36) HRH2F10KMT2AF2PRSS1
Trifluoroacetic Acid SCHEMBL7421816 0.83 NPY1R (0.38) HRH2F10KMT2AF2PRSS1
Trifluoroacetic Acid SCHEMBL7422047 0.82 HDAC3 (0.34) HRH2F10KMT2AGPR6F2
SCHEMBL5604353 0.78 F10 (0.38) F10F2PLGPROC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0853618-A4 SUBSTITUTED (SULFINIC ACID, SULFONIC ACID, SULFONYLAMINO OR SULFINYLAMINO) N- (AMINOIMINOMETHYL)PHENYLALKYL]-AZAHETEROCYCLYLAMIDE COMPOUNDS RHONE POULENC RORER PHARMA (US) 2000-03-15 EP claimed
EP-0853618-A1 SUBSTITUTED (SULFINIC ACID, SULFONIC ACID, SULFONYLAMINO OR SULFINYLAMINO) N- (AMINOIMINOMETHYL)PHENYLALKYL]-AZAHETEROCYCLYLAMIDE COMPOUNDS RHONE-POULENC RORER PHARMACEUTICALS, INC. (US) 1998-07-22 EP claimed
US-5612353-A ANTICOAGULANT RHONE-POULENC RORER PHARMACEUTICALS INC. (US) 1997-03-18 US claimed
WO-1996040679-A1 SUBSTITUTED (SULFINIC ACID, SULFONIC ACID, SULFONYLAMINO OR SULFINYLAMINO) N-[(AMINOIMINOMETHYL)PHENYLALKYL]-AZAHETEROCYCLYLAMIDE COMPOUNDS RHÔNE-POULENC RORER PHARMACEUTICALS INC. (US) 1996-12-19 WO claimed
EP-0853618-A4 SUBSTITUTED (SULFINIC ACID, SULFONIC ACID, SULFONYLAMINO OR SULFINYLAMINO) N- (AMINOIMINOMETHYL)PHENYLALKYL]-AZAHETEROCYCLYLAMIDE COMPOUNDS RHONE POULENC RORER PHARMA (US) 2000-03-15 EP disclosed
EP-0853618-A1 SUBSTITUTED (SULFINIC ACID, SULFONIC ACID, SULFONYLAMINO OR SULFINYLAMINO) N- (AMINOIMINOMETHYL)PHENYLALKYL]-AZAHETEROCYCLYLAMIDE COMPOUNDS RHONE-POULENC RORER PHARMACEUTICALS, INC. (US) 1998-07-22 EP disclosed
US-5612353-A ANTICOAGULANT RHONE-POULENC RORER PHARMACEUTICALS INC. (US) 1997-03-18 US disclosed
WO-1996040679-A1 SUBSTITUTED (SULFINIC ACID, SULFONIC ACID, SULFONYLAMINO OR SULFINYLAMINO) N-[(AMINOIMINOMETHYL)PHENYLALKYL]-AZAHETEROCYCLYLAMIDE COMPOUNDS RHÔNE-POULENC RORER PHARMACEUTICALS INC. (US) 1996-12-19 WO disclosed